SCHEMBL693837

SCHEMBL693837

CC(C(=O)O)c1ccc(C=O)cc1

nearest known ligand 0.59

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TYR P14679 1/20 0.59
AKR1C3 P42330 3/20 0.57
AKR1C2 P52895 2/20 0.57
PTGS2 P35354 14/20 0.57
PTGS1 P23219 11/20 0.53
LMNA P02545 2/20 0.53
CYP2C9 P11712 2/20 0.53
CXCR1 P25024 2/20 0.53
CXCR2 P25025 2/20 0.53
ALB P02768 1/20 0.53
ESR1 P03372 1/20 0.53
ALOX5 P09917 1/20 0.53
RARB P10826 1/20 0.53
ADRB3 P13945 1/20 0.53
NFKB1 P19838 1/20 0.53
HTR2A P28223 1/20 0.53
NR1I3 Q14994 1/20 0.53
SLC22A6 Q4U2R8 1/20 0.53
CXCL8 P10145 1/20 0.53
TSHR P16473 1/20 0.53

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
SCHEMBL11704768 1.00 TYR (0.59) TYRAKR1C3AKR1C2PTGS2PTGS1
SCHEMBL29954993 1.00 TYR (0.59) TYRAKR1C3AKR1C2PTGS2PTGS1
SCHEMBL59197 0.84 PTGS2 (0.74) AKR1C3AKR1C2PTGS2PTGS1LMNA
SCHEMBL11471204 0.82 AKR1C3 (0.59) TYRAKR1C3AKR1C2PTGS2PTGS1
SCHEMBL11434457 0.82 PTGS2 (0.55) AKR1C3AKR1C2PTGS2PTGS1LMNA
SCHEMBL1140292 0.82 TYR (0.57) TYRAKR1C3AKR1C2PTGS2ALDH1A1
SCHEMBL11434458 0.82 PTGS2 (0.55) AKR1C3AKR1C2PTGS2PTGS1LMNA
SCHEMBL6775188 0.82 PTGS2 (0.64) AKR1C3AKR1C2PTGS2PTGS1LMNA
SCHEMBL9420395 0.82 PTGS2 (0.55) AKR1C3AKR1C2PTGS2PTGS1LMNA
SCHEMBL1346361 0.82 PTGS2 (0.55) AKR1C3AKR1C2PTGS2PTGS1LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-116046948-A Related substance analysis method of compound preparation ibuprofen renin tablet 南京工业大学 2023-05-02 CN claimed
JP-4368353-A None JP disclosed
CN-116626188-A Method for detecting impurity morpholine in pebiprofen 湖南九典宏阳制药有限公司 2023-08-22 CN disclosed
CN-116046948-A Related substance analysis method of compound preparation ibuprofen renin tablet 南京工业大学 2023-05-02 CN disclosed
CN-113149826-A Preparation process of pelubiprofen 台州市源众药业有限公司 2021-07-23 CN disclosed
CN-107353195-B Preparation method of loxoprofen sodium ring-opening impurity 迪嘉药业集团有限公司 2020-10-13 CN disclosed
CN-106316837-A Preparation method for substituted phenylacetic acid derivatives 浙江九洲药业股份有限公司 2017-01-11 CN disclosed
EP-2733534-B1 COMPOSITION FOR FORMING FINE PATTERN AND METHOD FOR FORMING FINED PATTERN USING SAME MERCK PATENT GMBH (DE) 2016-09-14 EP disclosed
US-9394275-B2 Diamide compounds having muscarinic receptor antagonist and BETA2 adrenergic receptor agonist activity THERAVANCE RESPIRATORY COMPANY, LLC (US) 2016-07-19 US disclosed
US-9298094-B2 Composition for forming fine pattern and method for forming fined pattern using same MERCK PATENT GMBH (DE) 2016-03-29 US disclosed
EP-0689845-A2 Conjugates of methyltrithio antitumor agents and intermediates for their synthesis AMERICAN CYANAMID COMPANY (US) 1996-01-03 EP disclosed
JP-H04368353-A PRODUCTION OF 2-(P-FORMYLPHENYL)PROPIONIC ACID SANKYO CO LTD 1992-12-21 JP disclosed
EP-0169688-B1 PROCESS FOR PREPARING ANTI-INFLAMMATORY CYCLOALKYLIDENEMETHYLPHENYLACETIC ACID DERIVATIVES SANKYO COMPANY LIMITED (JP) 1988-09-28 EP disclosed
US-4673761-A Process for preparing anti-inflammatory cycloalkylidenemethylphenylacetic acid derivatives SANKYO COMPANY, LIMITED (JP) 1987-06-16 US disclosed
EP-0169688-A1 Process for preparing anti-inflammatory cycloalkylidenemethylphenylacetic acid derivatives SANKYO COMPANY LIMITED (JP) 1986-01-29 EP disclosed
US-4407823-A ANTIINFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 1983-10-04 US disclosed
EP-0007319-A1 Indan-1-carboxylic acid derivatives,process for their preparation and pharmaceutical preparations containing these compounds SCHERING AKTIENGESELLSCHAFT (DE) 1980-02-06 EP disclosed
US-4064132-A ANTIINFLAMMATORY AGENTS JANSSEN PHARMACEUTICA N.V. (BE) 1977-12-20 US disclosed
US-4060528-A ANTIINFLAMMATORY JANSSEN PHARMACEUTICA N.V. (BE) 1977-11-29 US disclosed
US-4035376-A ESTERS, AMIDES, HYDROXAMIC ACIDS, ANTIINFLAMMATORY JANSSEN PHARMACEUTICA N.V. (BE) 1977-07-12 US disclosed