SCHEMBL6936711

SCHEMBL6936711

CC(=NOCCOc1ccc(CC(Sc2ccccc2)C(=O)O)cc1)c1ccc(-c2ccccn2)cc1

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
PPARG P37231 18/20 0.46
PPARA Q07869 11/20 0.41
ALOX5 P09917 2/20 0.41
PTGES O14684 1/20 0.41
CYP1A2 P05177 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP19A1 P11511 1/20 0.40
CYP2C9 P11712 1/20 0.40
CYP2C19 P33261 1/20 0.40
PPARD Q03181 2/20 0.39
FFAR1 O14842 1/20 0.36

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
SCHEMBL6939444 1.00 PPARG (0.46) PPARGPPARAALOX5PTGESCYP1A2
SCHEMBL6937238 0.93 PPARG (0.44) PPARGPPARAALOX5PTGESCYP1A2
SCHEMBL6937241 0.93 PPARG (0.44) PPARGPPARAALOX5PTGESCYP1A2
SCHEMBL6936009 0.91 PPARG (0.47) PPARGPPARACYP1A2CYP2D6CYP19A1
SCHEMBL6936011 0.91 PPARG (0.47) PPARGPPARACYP1A2CYP2D6CYP19A1
SCHEMBL6939474 0.90 PPARG (0.46) PPARGPPARACYP1A2CYP2D6CYP19A1
SCHEMBL6939476 0.90 PPARG (0.46) PPARGPPARACYP1A2CYP2D6CYP19A1
SCHEMBL6933275 0.88 PPARG (0.44) PPARGPPARAALOX5PTGESCYP1A2
SCHEMBL6933273 0.88 PPARG (0.44) PPARGPPARAALOX5PTGESCYP1A2
SCHEMBL6933885 0.85 PPARG (0.57) PPARGPPARACYP1A2CYP2D6CYP19A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0916651-B1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES SANKYO CO (JP) 2003-10-15 EP claimed
US-6103907-A ALDOSE REDUCTASE INHIBITING ANTIDIABETIC AGENT SANKYO COMPANY, LIMITED (JP) 2000-08-15 US claimed
CN-1219927-A Phenylalkylcarboxylic acid derivatives SANKYO CO (JP) 1999-06-16 CN claimed
EP-0916651-A1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 1999-05-19 EP claimed
EP-0916651-B1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES SANKYO CO (JP) 2003-10-15 EP disclosed
US-6103907-A ALDOSE REDUCTASE INHIBITING ANTIDIABETIC AGENT SANKYO COMPANY, LIMITED (JP) 2000-08-15 US disclosed
CN-1219927-A Phenylalkylcarboxylic acid derivatives SANKYO CO (JP) 1999-06-16 CN disclosed
EP-0916651-A1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 1999-05-19 EP disclosed