SCHEMBL3559567

SCHEMBL3559567

CC(C(=O)O)c1cccs1

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CYP2C9 P11712 4/20 0.51
ALDH1A1 P00352 4/20 0.51
HPGD P15428 3/20 0.51
PTGS2 P35354 3/20 0.51
PTGS1 P23219 2/20 0.51
LMNA P02545 2/20 0.51
ALOX5 P09917 1/20 0.51
KDM4E B2RXH2 1/20 0.51
RXFP1 Q9HBX9 1/20 0.51
CES2 O00748 2/20 0.47
CES1 P23141 2/20 0.47
KEAP1 Q14145 1/20 0.47
CYP2C19 P33261 3/20 0.46
CYP3A4 P08684 2/20 0.46
ADRA2C P18825 1/20 0.46
MAOA P21397 1/20 0.46
ADRA1A P35348 1/20 0.46
DRD3 P35462 1/20 0.46
KCNH2 Q12809 1/20 0.46
CYP1A2 P05177 1/20 0.46

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
SCHEMBL15674870 1.00 CYP2C9 (0.51) CYP2C9ALDH1A1HPGDPTGS2PTGS1
SCHEMBL11922846 1.00 CYP2C9 (0.51) CYP2C9ALDH1A1HPGDPTGS2PTGS1
Hydrochloric Acid SCHEMBL5845619 0.98 CYP2C9 (0.50) CYP2C9ALDH1A1HPGDPTGS2PTGS1
SCHEMBL15695572 0.88 ALOX5 (0.51) CYP2C9ALDH1A1HPGDPTGS2PTGS1
SCHEMBL14408514 0.88 ALOX5 (0.51) CYP2C9ALDH1A1HPGDPTGS2PTGS1
SCHEMBL8910226 0.87 CYP2C9 (0.46) CYP2C9ALDH1A1HPGDPTGS2PTGS1
SCHEMBL27514420 0.85 ALOX5 (0.53) CYP2C9ALDH1A1HPGDPTGS2PTGS1
SCHEMBL3309888 0.84 ALOX5 (0.49) CYP2C9ALDH1A1HPGDPTGS2PTGS1
SCHEMBL6197782 0.83 ALOX5 (0.51) CYP2C9ALDH1A1HPGDPTGS2PTGS1
SCHEMBL8505076 0.83 ALOX5 (0.51) CYP2C9ALDH1A1HPGDPTGS2PTGS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-117705767-A Test instrument and test method for detecting side view haze 珠海兴业新材料科技有限公司 2024-03-15 CN claimed
CN-114874413-B Dispersing resin for cathode electrophoretic coating matched with film pretreatment and preparation method and application thereof 上海金力泰化工股份有限公司 2024-03-01 CN claimed
CN-116065950-A Intelligent drilling construction process based on oil gas development engineering driller surface layer construction 大庆石油管理局有限公司 2023-05-05 CN claimed
CN-114874413-A Dispersion resin for cathode electrophoretic coating matched with film pretreatment and preparation method and application thereof 上海金力泰化工股份有限公司 2022-08-09 CN claimed
CN-110127869-A A kind of environment-friendly type oil recovery neutral anti-incrustation corrosion inhibitor and preparation method thereof 黑龙江益瑞化工有限公司 2019-08-16 CN claimed
CN-107698554-A A kind of preparation method of non-steroidal antiphlogiston tiaprofenic acid 江苏工程职业技术学院 2018-02-16 CN claimed
CN-107573320-A A kind of preparation method of Tiaprofenic Acid 江苏工程职业技术学院 2018-01-12 CN claimed
CN-107540654-A A kind of synthesis technique of Tiaprofenic Acid 江苏工程职业技术学院 2018-01-05 CN claimed
CN-107501233-A A kind of synthesis technique of non-steroidal antiphlogiston tiaprofenic acid 江苏工程职业技术学院 2017-12-22 CN claimed
WO-2009055631-A1 CALCILYTIC COMPOUNDS SMITHKLINE BEECHAM CORPORATION (US) 2009-04-30 WO claimed
EP-0748802-B1 Process for the preparation of alpha-methyl-2-thiopheneacetic acid derivatives ERREGIERRE SPA (IT) 2001-03-28 EP claimed
WO-2000032638-A1 POLYSACCHARIDE CHIRAL ESTERS, ONE OF THE METHODS FOR PREPARING THEM AND THEIR USES FOR OBTAINING OPTICALLY ENRICHED ACIDS OR CHIRAL CHROMATOGRAPHY UNIVERSITE DE DROIT, D'ECONOMIE ET DES SCIENCES D'AIX-MARSEILLE (FR) 2000-06-08 WO claimed
US-5650522-A MULTISTAGE PROCESS TO FORM KETONE, THEN REACTION WITH HALODIESTER COMPOUND TO FORM KETOTHIOPHENEDIESTER THEN SAPONIFICATION WITH ALKALI AND MINERAL ACID ERREGIERRE S.P.A. (IT) 1997-07-22 US claimed
EP-0748802-A1 Process for the preparation of alpha-methyl-2-thiopheneacetic acid derivatives ERREGIERRE S.p.A. (IT) 1996-12-18 EP claimed
EP-0224401-B1 PROCESS FOR THE PREPARATION OF ALKANOIC ACIDS SOCIETE FRANCAISE HOECHST Société anonyme dite: (FR) 1990-01-17 EP claimed
EP-0124407-B1 PROCESS FOR THE PREPARATION OF ALKANOIC ACIDS SOCIETE FRANCAISE HOECHST Société anonyme dite: (FR) 1989-08-23 EP claimed
US-4690945-A ANTIINFLAMMATORY AGENTS; ANALGESICS LABORATORIOS MADAUS CERAFARM, S.A. (ES) 1987-09-01 US claimed
US-4515970-A Process for preparation of alkanoic acids SOCIETE FRANCAISE HOECHST (FR) 1985-05-07 US claimed
US-4219659-A Process for the preparation of thiophene derivatives and thiophene derivatives obtained therethrough SAGAMI CHEMICAL RESEARCH CENTER (JP) 1980-08-26 US claimed
US-4144248-A Aromatic acetic acid derivatives having sulfur atom at alpha-position and process for their preparation SAGAMI CHEMICAL RESEARCH CENTER (JP) 1979-03-13 US claimed