SCHEMBL1787570

SCHEMBL1787570

O[C@@H]1CCCN(Cc2ccccc2)C1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 1.00
CYP2D6 P10635 3/20 0.66
CYP1A2 P05177 1/20 0.66
CYP3A4 P08684 1/20 0.66
CYP2C19 P33261 1/20 0.66
HTT P42858 1/20 0.60
KDM4E B2RXH2 4/20 0.60
HPGD P15428 2/20 0.60
TSHR P16473 1/20 0.60
POLB P06746 1/20 0.60
SMN1; SMN2 Q16637 1/20 0.60
LTA4H P09960 1/20 0.59
FUCA1 P04066 2/20 0.54

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL5205368 1.00 ALDH1A1 (1.00) ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19
SCHEMBL1552926 1.00 ALDH1A1 (1.00) ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19
Methane SCHEMBL7287824 0.98 ALDH1A1 (0.97) ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19
Hydrochloric Acid SCHEMBL5343928 0.98 ALDH1A1 (0.97) ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19
SCHEMBL2538632 0.95 ALDH1A1 (0.90) ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19
SCHEMBL24023495 0.91 ALDH1A1 (0.82) ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19
SCHEMBL5745229 0.90 ALDH1A1 (0.81) ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19
SCHEMBL608225 0.89 ALDH1A1 (0.81) ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19
SCHEMBL741364 0.89 ALDH1A1 (0.81) ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19
SCHEMBL72716 0.89 ALDH1A1 (0.81) ALDH1A1CYP2D6CYP1A2CYP3A4CYP2C19

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 94 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113461598-B Process for producing piperidinol compound 山东华素制药有限公司 2023-04-18 CN claimed
CN-113640408-B Method for analyzing piperidinol compound 山东华素制药有限公司 2023-03-07 CN claimed
CN-113264868-B Improved synthesis method of 1-benzyl-3-piperidinol 山东华素制药有限公司 2022-12-02 CN claimed
CN-111848495-B Synthesis method of 1-benzyl-3-piperidinol 山东华素制药有限公司 2022-06-21 CN claimed
CN-111718250-B Method for preparing R-citronellal 万华化学集团股份有限公司 2022-04-22 CN claimed
CN-113640408-A Method for analyzing piperidinol compound 山东华素制药有限公司 2021-11-12 CN claimed
CN-113461598-A Process for producing piperidinol compound 山东华素制药有限公司 2021-10-01 CN claimed
CN-113264868-A Improved synthesis method of 1-benzyl-3-piperidinol 山东华素制药有限公司 2021-08-17 CN claimed
CN-113122050-A Quantum dot ink and preparation method of quantum dot film TCL集团股份有限公司 2021-07-16 CN claimed
CN-111848495-A Synthesis method of 1-benzyl-3-piperidinol 山东华素制药有限公司 2020-10-30 CN claimed
CN-111718250-A Method for preparing R-citronellal 万华化学集团股份有限公司 2020-09-29 CN claimed
EP-3115358-B1 METHOD OF PREPARATION AND CHIRAL INVERSION OF CHIRAL-1-T-BUTOXYCARBONYL-3-HYDROXY PIPERIDINE ABA CHEMICALS CORP (CN) 2019-09-11 EP claimed
EP-3170809-B1 METHOD FOR RECYCLING CHIRAL 1-BENZYL-3-HYDROXYPIPERIDINE BY RACEMIZATION ABA CHEMICALS CORP (CN) 2019-04-03 EP claimed
EP-3170809-A1 METHOD FOR RECYCLING CHIRAL 1-BENZYL-3-HYDROXYPIPERIDINE BY RACEMIZATION ABA Chemicals Corporation (CN) 2017-05-24 EP claimed
EP-3115358-A1 METHOD OF PREPARATION AND CHIRAL INVERSION OF CHIRAL-1-T-BUTOXYCARBONYL-3-HYDROXY PIPERIDINE ABA Chemicals Corporation (CN) 2017-01-11 EP claimed
CN-104140390-B The racemization recovery method of a kind of chirality 1-benzyl-3-hydroxy piperidine 雅本化学股份有限公司 2016-06-08 CN claimed
CN-103864673-B The method of the preparation of chirality-1-tertbutyloxycarbonyl-3-hydroxy piperidine and chirality upset ABA CHEMICALS CORPORATION (CN) 2016-03-23 CN claimed
CN-104140390-A Racemization recycling method for chirality 1-benzyl-3-hydroxypiperidine ABA CHEMICALS CORP 2014-11-12 CN claimed
CN-103864673-A Preparation of chirality-1-t-butyloxycarboryl-3-hydroxy piperidine and method for chirality turning ABA CHEMICALS CORP 2014-06-18 CN claimed
US-12630528-B2 Amino aryl derivative useful as diacylglycerol acyltransferase 2 inhibitor and use thereof LG CHEM, LTD. (KR) 2026-05-19 US disclosed
US-12497530-B2 Active energy ray polymerization initiator, active energy ray curing composition, active energy ray curing ink, aqueous active energy ray curing ink, container, image forming device, image forming method, and method of manufacturing active energy ray polymerization initiator RICOH COMPANY, LTD. (JP) 2025-12-16 US disclosed
CN-119977863-A Synthesis process of (((2S) -4- (-) -3-hydroxy-4-oxo-1- ((S) -2- (-) -butan-2-yl) carbamic acid tert-butyl ester 雅本化学股份有限公司 2025-05-13 CN disclosed
EP-4071147-B1 NOVEL AMINO ARYL DERIVATIVE USEFUL AS DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITOR AND USE THEREOF LG CHEMICAL LTD (KR) 2025-03-26 EP disclosed
CN-114846013-B Novel aminoaryl derivatives useful as diacylglycerol acyltransferase 2 inhibitors and uses thereof 株式会社LG化学 2024-12-20 CN disclosed
CN-117929563-A Method for separating and measuring impurities and residual solvents in 1-benzyl-3-piperidinol 重庆华邦制药有限公司 2024-04-26 CN disclosed
CN-113461598-B Process for producing piperidinol compound 山东华素制药有限公司 2023-04-18 CN disclosed
CN-113461598-B Process for producing piperidinol compound 山东华素制药有限公司 2023-04-18 CN disclosed
CN-113265392-B Cyano-group transfer catalyst and preparation method thereof 山东华素制药有限公司 2023-03-24 CN disclosed
US-20230078941-A1 NOVEL AMINO ARYL DERIVATIVE USEFUL AS DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITOR AND USE THEREOF LG CHEM, LTD. (KR) 2023-03-16 US disclosed
CN-113640408-B Method for analyzing piperidinol compound 山东华素制药有限公司 2023-03-07 CN disclosed
US-20230032881-A1 ACTIVE ENERGY RAY POLYMERIZATION INITIATOR, ACTIVE ENERGY RAY CURING COMPOSITION, ACTIVE ENERGY RAY CURING INK, AQUEOUS ACTIVE ENERGY RAY CURING INK, CONTAINER, IMAGE FORMING DEVICE, IMAGE FORMING METHOD, AND METHOD OF MANUFACTURING ACTIVE ENERGY RAY POLYMERIZATION INITIATOR RICOH COMPANY, LTD. (JP) 2023-02-02 US disclosed
CN-113264868-B Improved synthesis method of 1-benzyl-3-piperidinol 山东华素制药有限公司 2022-12-02 CN disclosed
CN-113264868-B Improved synthesis method of 1-benzyl-3-piperidinol 山东华素制药有限公司 2022-12-02 CN disclosed
EP-3148518-B1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PRIVATE LTD (IN) 2022-11-30 EP disclosed
CN-113122050-B Quantum dot ink and preparation method of quantum dot film TCL科技集团股份有限公司 2022-11-04 CN disclosed
EP-4071147-A1 NOVEL AMINO ARYL DERIVATIVE USEFUL AS DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITOR AND USE THEREOF Lg Chem, Ltd. (KR) 2022-10-12 EP disclosed
CN-113426468-B Wastewater treatment material and preparation method thereof 山东华素制药有限公司 2022-09-16 CN disclosed
CN-114846013-A Novel aminoaryl derivatives useful as diacylglycerol acyltransferase 2 inhibitors and uses thereof 株式会社LG化学 2022-08-02 CN disclosed
CN-111778297-B Improved synthesis method of 1-benzyl-3-piperidinol intermediate 山东华素制药有限公司 2022-07-29 CN disclosed
CN-113307327-B Wastewater treatment method for 1-benzyl-3-piperidinol 山东华素制药有限公司 2022-07-12 CN disclosed
CN-111848495-B Synthesis method of 1-benzyl-3-piperidinol 山东华素制药有限公司 2022-06-21 CN disclosed
CN-111718250-B Method for preparing R-citronellal 万华化学集团股份有限公司 2022-04-22 CN disclosed
CN-113640408-A Method for analyzing piperidinol compound 山东华素制药有限公司 2021-11-12 CN disclosed
CN-113461598-A Process for producing piperidinol compound 山东华素制药有限公司 2021-10-01 CN disclosed
CN-113461598-A Process for producing piperidinol compound 山东华素制药有限公司 2021-10-01 CN disclosed
CN-113426468-A Wastewater treatment material and preparation method thereof 山东华素制药有限公司 2021-09-24 CN disclosed
CN-113307327-A Wastewater treatment method for 1-benzyl-3-piperidinol 山东华素制药有限公司 2021-08-27 CN disclosed
CN-113264868-A Improved synthesis method of 1-benzyl-3-piperidinol 山东华素制药有限公司 2021-08-17 CN disclosed
CN-113264868-A Improved synthesis method of 1-benzyl-3-piperidinol 山东华素制药有限公司 2021-08-17 CN disclosed
CN-113265392-A Cyano-group transfer catalyst and preparation method thereof 山东华素制药有限公司 2021-08-17 CN disclosed
CN-113122050-A Quantum dot ink and preparation method of quantum dot film TCL集团股份有限公司 2021-07-16 CN disclosed
WO-2021133035-A1 NOVEL AMINO ARYL DERIVATIVE USEFUL AS DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITOR AND USE THEREOF 주식회사 엘지화학 2021-07-01 WO disclosed
US-20210093618-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2021-04-01 US disclosed
CN-111848495-A Synthesis method of 1-benzyl-3-piperidinol 山东华素制药有限公司 2020-10-30 CN disclosed
CN-111778297-A Improved synthesis method of 1-benzyl-3-piperidinol intermediate 山东华素制药有限公司 2020-10-16 CN disclosed
CN-111718250-A Method for preparing R-citronellal 万华化学集团股份有限公司 2020-09-29 CN disclosed
US-20200108054-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2020-04-09 US disclosed
CN-105793238-B Substituted benzamides and methods of use thereof 基因泰克公司 2019-12-24 CN disclosed
EP-3115358-B1 METHOD OF PREPARATION AND CHIRAL INVERSION OF CHIRAL-1-T-BUTOXYCARBONYL-3-HYDROXY PIPERIDINE ABA CHEMICALS CORP (CN) 2019-09-11 EP disclosed
EP-3170809-B1 METHOD FOR RECYCLING CHIRAL 1-BENZYL-3-HYDROXYPIPERIDINE BY RACEMIZATION ABA CHEMICALS CORP (CN) 2019-04-03 EP disclosed
EP-3170809-B1 METHOD FOR RECYCLING CHIRAL 1-BENZYL-3-HYDROXYPIPERIDINE BY RACEMIZATION ABA CHEMICALS CORP (CN) 2019-04-03 EP disclosed
US-10207993-B2 Compounds as anti-tubercular agents SPHAERA PHARMA PVT. LTD. (IN) 2019-02-19 US disclosed
US-20170334851-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2017-11-23 US disclosed
US-20170334851-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2017-11-23 US disclosed
US-9694002-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-07-04 US disclosed
US-20170183305-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2017-06-29 US disclosed
US-20170183305-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS SPHAERA PHARMA PVT. LTD. (IN) 2017-06-29 US disclosed
EP-3170809-A1 METHOD FOR RECYCLING CHIRAL 1-BENZYL-3-HYDROXYPIPERIDINE BY RACEMIZATION ABA Chemicals Corporation (CN) 2017-05-24 EP disclosed
US-20170087136-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2017-03-30 US disclosed
US-9546164-B2 Substituted benzamides and methods of use thereof GENENTECH, INC. (US) 2017-01-17 US disclosed
EP-3115358-A1 METHOD OF PREPARATION AND CHIRAL INVERSION OF CHIRAL-1-T-BUTOXYCARBONYL-3-HYDROXY PIPERIDINE ABA Chemicals Corporation (CN) 2017-01-11 EP disclosed
EP-3115358-A1 METHOD OF PREPARATION AND CHIRAL INVERSION OF CHIRAL-1-T-BUTOXYCARBONYL-3-HYDROXY PIPERIDINE ABA Chemicals Corporation (CN) 2017-01-11 EP disclosed
EP-3074377-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF Genentech, Inc. (US) 2016-10-05 EP disclosed
CN-104140390-B The racemization recovery method of a kind of chirality 1-benzyl-3-hydroxy piperidine 雅本化学股份有限公司 2016-06-08 CN disclosed
CN-103864673-B The method of the preparation of chirality-1-tertbutyloxycarbonyl-3-hydroxy piperidine and chirality upset ABA CHEMICALS CORPORATION (CN) 2016-03-23 CN disclosed
CN-103864673-B The method of the preparation of chirality-1-tertbutyloxycarbonyl-3-hydroxy piperidine and chirality upset ABA CHEMICALS CORPORATION (CN) 2016-03-23 CN disclosed
WO-2015131299-A1 METHOD OF PREPARATION AND CHIRAL INVERSION OF CHIRAL-1-T-BUTOXYCARBONYL-3-HYDROXY PIPERIDINE 雅本化学股份有限公司 2015-09-11 WO disclosed
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF XENON PHARMACEUTICALS INC. (CA) 2015-09-10 US disclosed
WO-2015078374-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF GENENTECH, INC. (US) 2015-06-04 WO disclosed
CN-104140390-A Racemization recycling method for chirality 1-benzyl-3-hydroxypiperidine ABA CHEMICALS CORP 2014-11-12 CN disclosed
CN-103864673-A Preparation of chirality-1-t-butyloxycarboryl-3-hydroxy piperidine and method for chirality turning ABA CHEMICALS CORP 2014-06-18 CN disclosed
CN-103864673-A Preparation of chirality-1-t-butyloxycarboryl-3-hydroxy piperidine and method for chirality turning ABA CHEMICALS CORP 2014-06-18 CN disclosed
US-8324222-B2 Cyclically substituted furopyrimidine derivatives and use thereof BAYER INTELLECTUAL PROPERTY GMBH (DE) 2012-12-04 US disclosed
WO-2012116945-A2 LIQUID PHASE SEPARATION OF PLASMID DNA ISOFORMS AND TOPOISOMERS BOEHRINGER INGELHEIM RCV GMBH & CO KG (AT) 2012-09-07 WO disclosed
US-20120220729-A1 LIQUID PHASE SEPARATION OF PLASMID DNA ISOFORMS AND TOPOISOMERS BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) 2012-08-30 US disclosed
US-20110124665-A1 Novel, Cyclically Substituted Furopyrimidine Derivatives and Use Thereof BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2011-05-26 US disclosed
EP-1966218-B1 NOVEL, CYCLIC SUBSTITUTED FUROPYRIMIDINE DERIVATIVES AND USE THEREOF FOR TREATING CARDIOVASCULAR DISEASES BAYER SCHERING PHARMA AG (DE) 2010-07-14 EP disclosed
US-20080274107-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2008-11-06 US disclosed
US-20080274107-A1 Tyrosine kinase inhibitors MERCK SHARP & DOHME CORP. 2008-11-06 US disclosed
WO-2008131859-A2 USE OF CYCLICALLY SUBSTITUTED FUROPYRIMIDINE DERIVATIVES FOR TREATING PULMONARY ARTERIAL HYPERTONIA BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2008-11-06 WO disclosed
EP-1966218-A1 NOVEL, CYCLIC SUBSTITUTED FUROPYRIMIDINE DERIVATIVES AND USE THEREOF FOR TREATING CARDIOVASCULAR DISEASES Bayer HealthCare AG (DE) 2008-09-10 EP disclosed
WO-2007079861-A1 NOVEL, CYCLIC SUBSTITUTED FUROPYRIMIDINE DERIVATIVES AND USE THEREOF FOR TREATING CARDIOVASCULAR DISEASES BAYER HEALTHCARE AG (DE) 2007-07-19 WO disclosed
US-7186723-B2 Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2007-03-06 US disclosed
US-7186723-B2 Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2007-03-06 US disclosed
US-7186723-B2 Tyrosine kinase inhibitors MERCK & CO., INC. (US) 2007-03-06 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (12 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10207993-B2 Compounds as anti-tubercular agents FNTB, G6PD, PGGT1B ALDH1A1 193/4885CYP2D6 865/4885CYP1A2 612/4885
US-20210093618-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, SULT2A1 ALDH1A1 912/4885CYP2D6 133/4885CYP1A2 79/4885
US-20120220729-A1 LIQUID PHASE SEPARATION OF PLASMID DNA ISOFORMS AND TOPOISOMERS PCNA, RCC1, POLN ALDH1A1 3661/4885CYP2D6 3972/4885CYP1A2 4614/4885
US-20230078941-A1 NOVEL AMINO ARYL DERIVATIVE USEFUL AS DIACYLGLYCEROL ACYLTRANSFERASE 2 INHIBITOR AND USE THEREOF DGAT2, DGAT1, PLAAT2 ALDH1A1 480/4885CYP2D6 390/4885CYP1A2 398/4885
US-20110124665-A1 Novel, Cyclically Substituted Furopyrimidine Derivatives and Use Thereof DPYD, TK2, TPMT ALDH1A1 472/4885CYP2D6 220/4885CYP1A2 360/4885
US-20170334851-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS FNTB, PGGT1B, GGPS1 ALDH1A1 467/4885CYP2D6 1722/4885CYP1A2 1475/4885
US-12630528-B2 Amino aryl derivative useful as diacylglycerol acyltransferase 2 inhibitor and use thereof DGAT2, DGAT1, SOAT2 ALDH1A1 597/4885CYP2D6 288/4885CYP1A2 368/4885
US-20150252038-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, RRM1 ALDH1A1 1306/4885CYP2D6 401/4885CYP1A2 178/4885
US-20170087136-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF C1R, SRR, PNISR ALDH1A1 1503/4885CYP2D6 220/4885CYP1A2 272/4885
US-20200108054-A1 SUBSTITUTED BENZAMIDES AND METHODS OF USE THEREOF BRIX1, RDX, SULT2A1 ALDH1A1 912/4885CYP2D6 133/4885CYP1A2 79/4885
US-20080274107-A1 Tyrosine kinase inhibitors ERBB2, TYRO3, TIE1 ALDH1A1 3104/4885CYP2D6 4826/4885CYP1A2 4812/4885
US-20170183305-A1 NOVEL COMPOUNDS AS ANTI-TUBERCULAR AGENTS FNTB, PGGT1B, GGPS1 ALDH1A1 467/4885CYP2D6 1722/4885CYP1A2 1475/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.