SCHEMBL317079

SCHEMBL317079

[O-][n+]1ccc(-c2ccccc2)cc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC22A2 O15244 1/20 0.55
SLC22A1 O15245 1/20 0.55
SLC22A3 O75751 1/20 0.55
SLC6A4 P31645 1/20 0.55
ALDH1A1 P00352 2/20 0.53
CYP3A4 P08684 2/20 0.42
CYP2C19 P33261 1/20 0.42
CYP2E1 P05181 1/20 0.40
CYP2A6 P11509 1/20 0.40
CYP2B6 P20813 1/20 0.40
MAPK1 P28482 1/20 0.39
CYP1A2 P05177 1/20 0.39
TAAR1 Q96RJ0 1/20 0.39
HSD17B10 Q99714 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
NOTUM Q6P988 1/20 0.39
MMP3 P08254 1/20 0.39
BCL2L1 Q07817 1/20 0.39
POLB P06746 1/20 0.39
CA12 O43570 1/20 0.37

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
Hydrochloric Acid SCHEMBL10569329 0.97 SLC22A2 (0.52) SLC22A2SLC22A1SLC22A3SLC6A4ALDH1A1
Biphenyl SCHEMBL27555386 0.88 ALDH1A1 (0.53) SLC22A2SLC22A1SLC22A3SLC6A4ALDH1A1
SCHEMBL4035335 0.87 POLB (0.46) SLC22A2SLC22A1SLC22A3SLC6A4CYP3A4
Water SCHEMBL31152424 0.84 POLB (0.43) SLC22A2SLC22A1SLC22A3SLC6A4CYP3A4
Biphenyl SCHEMBL4002609 0.73 ALDH1A1 (1.00) SLC22A2SLC22A1SLC22A3SLC6A4ALDH1A1
SCHEMBL30629023 0.73 ALDH1A1 (1.00) SLC22A2SLC22A1SLC22A3SLC6A4ALDH1A1
Biphenyl SCHEMBL28890607 0.73 ALDH1A1 (1.00) SLC22A2SLC22A1SLC22A3SLC6A4ALDH1A1
Biphenyl SCHEMBL1358618 0.73 ALDH1A1 (1.00) SLC22A2SLC22A1SLC22A3SLC6A4ALDH1A1
Biphenyl SCHEMBL29008551 0.73 ALDH1A1 (1.00) SLC22A2SLC22A1SLC22A3SLC6A4ALDH1A1
Biphenyl SCHEMBL2548048 0.73 ALDH1A1 (1.00) SLC22A2SLC22A1SLC22A3SLC6A4ALDH1A1

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 352 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250326709-A1 THE MICROWAVE-ASSISTED CATALYTIC AMIDATION OF ORGANIC AMINES WITH CARBOXYLIC ACIDS PURDUE RESEARCH FOUNDATION (US) 2025-10-23 US claimed
CN-119899079-A Naphthalene ring carbon-14 marked 2, 6-diisopropylnaphthalene and synthesis method thereof 浙江爱索拓标记医药科技有限公司 2025-04-29 CN claimed
CN-116903469-A Synthesis method of 4-nitrobenzophenone compound 台州学院 2023-10-20 CN claimed
US-9287052-B2 Additives for dye-sensitized solar cells MERCK PATENT GMBH (DE) 2016-03-15 US claimed
US-20130292601-A1 Additives for Dye-Sensitized Solar Cells MERCK PATENT GMBH (DE) 2013-11-07 US claimed
WO-2007000329-A2 EPOXIDATION OF ALPHA, BETA-UNSATURATED KETONES LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2007-01-04 WO claimed
EP-0944659-B1 METHOD FOR PRODUCING LINEAR BLOCK COPOLYMERS BASF AG (DE) 2000-10-18 EP claimed
US-5663393-A CYCLIZATION; DECYCLIZATION; HYDROLYSIS; HYDROGENATION RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1997-09-02 US claimed
US-5637739-A ORGANOMETALLIC CATALYSTS FOR ENANTIOSELECTIVELY EPOXIDIZING PROCHIRAL OLEFINS RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1997-06-10 US claimed
WO-1996024601-A1 COMPLEXES, PROCESSES FOR THEIR PREPARATION AND THEIR USE UNIVERSITY COLLEGE DUBLIN (IE) 1996-08-15 WO claimed
EP-0603649-B1 Substituted 4-phenyl-pyridones and 4-phenyl-2-alkoxypyridines as HMG-CoA reductase inhibitors BAYER AG (DE) 1996-07-10 EP claimed
CN-1117965-A Substituted 4-phenyl-pyridones and 4-phenyl-2-alkoxypyridines BAYER AG (DE) 1996-03-06 CN claimed
EP-0643626-A4 CHIRAL CATALYSTS, CATALYTIC OXIDATION AND DISPROPORTIONATION REACTIONS, AND METHODS OF PRODUCING EPOXYCHROMANS AND TAXOL. RES CORP TECHNOLOGIES INC (US) 1995-12-06 EP claimed
US-5418243-A Anticholesterol agents BAYER AKTIENGESELLSCHAFT (DE) 1995-05-23 US claimed
EP-0643626-A1 CHIRAL CATALYSTS, CATALYTIC OXIDATION AND DISPROPORTIONATION REACTIONS, AND METHODS OF PRODUCING EPOXYCHROMANS AND TAXOL RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1995-03-22 EP claimed
EP-0603649-A1 Substituted 4-phenyl-pyridones and 4-phenyl-2-alkoxypyridines as HMG-CoA reductase inhibitors BAYER AG (DE) 1994-06-29 EP claimed
WO-1993003838-A1 CHIRAL CATALYSTS, CATALYTIC OXIDATION AND DISPROPORTIONATION REACTIONS, AND METHODS OF PRODUCING EPOXYCHROMANS AND TAXOL RESEARCH CORPORATION TECHNOLOGIES, INC. (US) 1993-03-04 WO claimed
US-4187105-A Photosensitive image forming composition containing at least one substituted bis-diaryl vinylidene compound and/or at least one substituted bis-diaryl imine compound HORIZONS RESEARCH INCORPORATED (US) 1980-02-05 US claimed
US-20250326709-A1 THE MICROWAVE-ASSISTED CATALYTIC AMIDATION OF ORGANIC AMINES WITH CARBOXYLIC ACIDS PURDUE RESEARCH FOUNDATION (US) 2025-10-23 US disclosed
US-3986880-A NON-SILVER, LEUCO DYES, PLASTICIZERS, TRIPHENYLCARBINOL, AND ALCOHOLS OR PHENOLS HORIZONS INCORPORATED A DIVISION OF HORIZONS RESEARCH INCORPORATED (US) 1976-10-19 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 (1 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-20250326709-A1 THE MICROWAVE-ASSISTED CATALYTIC AMIDATION OF ORGANIC AMINES WITH CARBOXYLIC ACIDS NAAA, OAT, PAM SLC22A2 4418/4885SLC22A1 4586/4885SLC22A3 4499/4885

“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.