SCHEMBL941594

SCHEMBL941594

O=C(NC(=O)[C@@H]1CCCN1)OCc1ccccc1

nearest known ligand 0.59

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR2C P28335 3/20 0.59
HTR2B P41595 2/20 0.59
CTSC P53634 1/20 0.52
TSHR P16473 2/20 0.47
ALDH1A1 P00352 2/20 0.47
GAA P10253 1/20 0.47
EPHX1 P07099 1/20 0.45
MEN1 O00255 1/20 0.44
KMT2A Q03164 1/20 0.44
KDM4E B2RXH2 1/20 0.44
CPB1 P15086 1/20 0.44

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
SCHEMBL11337359 0.96 HTR2C (0.55) HTR2CHTR2BCTSCTSHRALDH1A1
SCHEMBL9464553 0.88 ALDH1A1 (0.58) HTR2CHTR2BCTSCTSHRALDH1A1
SCHEMBL9464997 0.88 ALDH1A1 (0.58) HTR2CHTR2BCTSCTSHRALDH1A1
Hydrochloric Acid SCHEMBL15366199 0.84 ALDH1A1 (0.61) HTR2CHTR2BCTSCTSHRALDH1A1
SCHEMBL12479526 0.83 GLA (0.43) HTR2CHTR2BTSHRALDH1A1GAA
Hydrochloric Acid SCHEMBL11262139 0.83 HTR2C (0.50) HTR2CHTR2BCTSCALDH1A1GAA
SCHEMBL16857534 0.82 ALDH1A1 (0.45) HTR2CHTR2BTSHRALDH1A1GAA
SCHEMBL8773302 0.82 HTR2C (0.63) HTR2CHTR2BCTSCTSHRMEN1
SCHEMBL8134913 0.82 HTR2C (0.63) HTR2CHTR2BCTSCTSHRMEN1
SCHEMBL16857533 0.82 ALDH1A1 (0.45) HTR2CHTR2BTSHRALDH1A1GAA

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 20 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113398986-B PH sensitive catalyst for catalyzing asymmetric Aldol reaction and preparation method thereof 北京工业大学 2023-06-06 CN claimed
US-20250197905-A1 LEGIONAMINIC ACID GLYCOSYLTRANSFERASES FOR CHEMOENZYMATIC SYNTHESIS OF GLYCANS AND GLYCOCONJUGATES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2025-06-19 US disclosed
WO-2023183781-A2 LEGIONAMINIC ACID GLYCOSYLTRANSFERASES FOR CHEMOENZYMATIC SYNTHESIS OF GLYCANS AND GLYCOCONJUGATES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) 2023-09-28 WO disclosed
CN-113398986-B PH sensitive catalyst for catalyzing asymmetric Aldol reaction and preparation method thereof 北京工业大学 2023-06-06 CN disclosed
US-20220145343-A1 MATERIALS AND METHODS FOR THE PREPARATION OF BACTERIAL CAPSULAR POLYSACCHARIDES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2022-05-12 US disclosed
CN-104086475-A Preparation method of N-carbobenzoxy-L-prolinamide SUZHOU TIANMA SPECIALTY CHEMICALS CO LTD 2014-10-08 CN disclosed
CN-104086475-A Preparation method of N-carbobenzoxy-L-prolinamide SUZHOU TIANMA SPECIALTY CHEMICALS CO LTD 2014-10-08 CN disclosed
CN-103360296-A New synthetic method of high-optical activity prolinamide LIANYUNGANG DUXIANG CHEMICAL CO LTD 2013-10-23 CN disclosed
US-8372985-B2 Process of making α-aminooxyketone/α-aminooxyaldehyde and α-hydroxyketone/α-hydroxyaldehyde compounds and a process of making reaction products from cyclic α, β-unsaturated ketone substrates and nitroso substrates JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2013-02-12 US disclosed
US-20120302792-A1 PROCESS OF MAKING ALPHA-AMINOOXYKETONE/ALPHA-AMINOOXYALDEHYDE AND ALPHA-HYDROXYKETONE/ALPHA-HYDROXYALDEHYDE COMPOUNDS AND A PROCESS MAKING REACTION PRODUCTS FROM CYCLIC ALPHA, BETA-UNSATURATED KETONE SUBSTRATES AND NITROSO SUBSTRATES JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2012-11-29 US disclosed
US-8252941-B2 Process of making alpha-aminooxyketone/alpha-aminooxyaldehyde and alpha-hydroxyketone/alpha-hydroxyaldehyde compounds and a process making reaction products from cyclic alpha, beta-unsaturated ketone substrates and nitroso substrates JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2012-08-28 US disclosed
US-20110034654-A1 POLYMER ORGANOCATALYST AND PREPARATION PROCESS UNIVERSITETET I OSLO (NO) 2011-02-10 US disclosed
US-7872123-B2 Process of making α-aminooxyketone/α-aminooxyaldehyde and α-hydroxyketone/α-hydroxyaldehyde compounds and a process making reaction products from cyclic α,β-unsaturated ketone substrates and nitroso substrates JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2011-01-18 US disclosed
EP-2240521-A1 POLYMER ORGANOCATALYST AND PREPARATION PROCESS Universitetet I Oslo (NO) 2010-10-20 EP disclosed
US-20100099915-A1 PROCESS OF MAKING ALPHA-AMINOOXYKETONE/ALPHA-AMINOOXYALDEHYDE AND ALPHA-HYDROXYKETONE/ALPHA-HYDROXYALDEHYDE COMPOUNDS AND A PROCESS MAKING REACTION PRODUCTS FROM CYCLIC ALPHA, BETA-UNSATURATED KETONE SUBSTRATES AND NITROSO SUBSTRATES JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2010-04-22 US disclosed
WO-2009087177-A1 POLYMER ORGANOCATALYST AND PREPARATION PROCESS UNIVERSITETET I OSLO (NO) 2009-07-16 WO disclosed
US-20070037973-A1 reacting a cyclic alpha , beta -unsaturated ketone compound with a nitroso compound in the presence of a proline-based catalyst to provide 7-Phenyl-6-oxa-7-aza-bicyclo[3.2.2]nonan-9-one or derivatives; catalytic asymmetric O-nitroso Aldol/Michael reaction JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2007-02-15 US disclosed
EP-1742905-A2 PROCESS OF MAKING ALFA-AMINOOXYKETONE/ ALFA-AMINOOXYALDEHYDE AND ALFA-HYDROXYKETONE/ ALFA-HYDROXYALDEHYDE COMPOUNDS AND A PROCESS OF MAKING REACTION PRODUCTS FROM CYCLIC ALFA, BETA-UNSATURATED KETONE SUBSTRATES AND NITROSO SUBSTRATES Japan Science and Technology Agency (JP) 2007-01-17 EP disclosed
WO-2005090294-A2 PROCESS OF MAKING α-AMINOOXYKETONE/α-AMINOOXYALDEHYDE AND α-HYDROXYKETONE/α-HYDROXYALDEHYDE COMPOUNDS AND A PROCESS OF MAKING REACTION PRODUCTS FROM CYCLIC α,ß-UNSATURATED KETONE SUBSTRATES AND NITROSO SUBSTRATES JAPAN SCIENCE AND TECHNOLOGY AGENCY (JP) 2005-09-29 WO disclosed
EP-0176005-A1 Novel platinum complexes Chugai Seiyaku Kabushiki Kaisha (JP) 1986-04-02 EP 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 (6 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-20110034654-A1 POLYMER ORGANOCATALYST AND PREPARATION PROCESS HRH3, HRH4, H1-3 HTR2C 1309/4885HTR2B 1694/4885CTSC 3356/4885
US-20220145343-A1 MATERIALS AND METHODS FOR THE PREPARATION OF BACTERIAL CAPSULAR POLYSACCHARIDES NANS, GMDS, MGAM HTR2C 4808/4885HTR2B 4785/4885CTSC 1581/4885
US-20070037973-A1 reacting a cyclic alpha , beta -unsaturated ketone compound with a nitroso compound in the presence of a proline-based catalyst to provide 7-Phenyl-6-oxa-7-aza-bicyclo[3.2.2]nonan-9-one or derivatives; catalytic asymmetric O-nitroso Aldol/Michael reaction XDH, PDXK, AOX1 HTR2C 3694/4885HTR2B 3579/4885CTSC 4375/4885
US-20250197905-A1 LEGIONAMINIC ACID GLYCOSYLTRANSFERASES FOR CHEMOENZYMATIC SYNTHESIS OF GLYCANS AND GLYCOCONJUGATES FNTA, MAGT1, FNTB HTR2C 4850/4885HTR2B 4814/4885CTSC 1664/4885
US-20100099915-A1 PROCESS OF MAKING ALPHA-AMINOOXYKETONE/ALPHA-AMINOOXYALDEHYDE AND ALPHA-HYDROXYKETONE/ALPHA-HYDROXYALDEHYDE COMPOUNDS AND A PROCESS MAKING REACTION PRODUCTS FROM CYCLIC ALPHA, BETA-UNSATURATED KETONE SUBSTRATES AND NITROSO SUBSTRATES XDH, QSOX1, KMO HTR2C 2066/4885HTR2B 2050/4885CTSC 4262/4885
US-20120302792-A1 PROCESS OF MAKING ALPHA-AMINOOXYKETONE/ALPHA-AMINOOXYALDEHYDE AND ALPHA-HYDROXYKETONE/ALPHA-HYDROXYALDEHYDE COMPOUNDS AND A PROCESS MAKING REACTION PRODUCTS FROM CYCLIC ALPHA, BETA-UNSATURATED KETONE SUBSTRATES AND NITROSO SUBSTRATES XDH, AOX1, QSOX1 HTR2C 1505/4885HTR2B 1795/4885CTSC 3987/4885

“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.