SCHEMBL6933273

SCHEMBL6933273

CCCSC(Cc1ccc(OCCO/N=C(/C)c2ccc(-c3ccccn3)cc2)cc1)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PPARG P37231 17/20 0.44
CYP2C19 P33261 2/20 0.43
CYP1A2 P05177 1/20 0.43
CYP2D6 P10635 1/20 0.43
CYP19A1 P11511 1/20 0.43
CYP2C9 P11712 1/20 0.43
PPARA Q07869 13/20 0.40
PPARD Q03181 2/20 0.38
PTGES O14684 1/20 0.36
ALOX5 P09917 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
SCHEMBL6933275 1.00 PPARG (0.44) PPARGCYP2C19CYP1A2CYP2D6CYP19A1
SCHEMBL6939474 0.93 PPARG (0.46) PPARGCYP2C19CYP1A2CYP2D6CYP19A1
SCHEMBL6939476 0.93 PPARG (0.46) PPARGCYP2C19CYP1A2CYP2D6CYP19A1
SCHEMBL6936011 0.90 PPARG (0.47) PPARGCYP2C19CYP1A2CYP2D6CYP19A1
SCHEMBL6936009 0.90 PPARG (0.47) PPARGCYP2C19CYP1A2CYP2D6CYP19A1
SCHEMBL6939444 0.88 PPARG (0.46) PPARGCYP2C19CYP1A2CYP2D6CYP19A1
SCHEMBL6936711 0.88 PPARG (0.46) PPARGCYP2C19CYP1A2CYP2D6CYP19A1
SCHEMBL6939267 0.85 PPARG (0.49) PPARGCYP2C19CYP1A2CYP2D6CYP19A1
SCHEMBL6939273 0.85 PPARG (0.49) PPARGCYP2C19CYP1A2CYP2D6CYP19A1
SCHEMBL6936503 0.85 PPARG (0.49) PPARGCYP2C19CYP1A2CYP2D6CYP19A1

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 6 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
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
EP-0916651-A1 PHENYLALKYLCARBOXYLIC ACID DERIVATIVES Sankyo Company, Limited (JP) 1999-05-19 EP disclosed