SCHEMBL9614239

SCHEMBL9614239

CC(C)(C)c1ccc(OC(CCCCCCc2ccccc2)C(=O)O)cc1

nearest known ligand 0.63

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PPARG P37231 15/20 0.63
PPARA Q07869 14/20 0.63
PTGES O14684 1/20 0.51
ALOX5 P09917 1/20 0.51
CTRC Q99895 1/20 0.51
POLB P06746 1/20 0.47
GAA P10253 1/20 0.47
CYP2C19 P33261 1/20 0.47

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
SCHEMBL9696796 1.00 PPARG (0.63) PPARGPPARAPTGESALOX5CTRC
SCHEMBL9696319 0.95 PPARG (0.61) PPARGPPARAPTGESALOX5CTRC
SCHEMBL9614213 0.90 PPARA (0.56) PPARGPPARACTRC
SCHEMBL9696474 0.90 PPARG (0.56) PPARGPPARAPTGESALOX5CTRC
SCHEMBL9614193 0.89 PPARA (0.73) PPARGPPARA
SCHEMBL9614218 0.89 PPARA (0.73) PPARGPPARA
SCHEMBL9695306 0.87 PPARG (0.53) PPARGPPARAPTGESALOX5CTRC
SCHEMBL10419541 0.87 PPARG (0.72) PPARGPPARAPTGESALOX5CTRC
SCHEMBL10419347 0.86 PPARG (0.67) PPARGPPARAPTGESALOX5CTRC
SCHEMBL10419468 0.86 PPARG (0.67) PPARGPPARAPTGESALOX5CTRC

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-1992017435-A1 OPTICALLY ACTIVE CARBOXYLIC ACIDS AND MEDICAMENTS CONTAINING THEM BOEHRINGER MANNHEIM GMBH (DE) 1992-10-15 WO disclosed
EP-0507238-A1 Optically active carboxylic acids and medicinal preparations containing them Roche Diagnostics GmbH (DE) 1992-10-07 EP disclosed
US-5145611-A Diabetes BOEHRINGER MANNHEIM GMBH (DE) 1992-09-08 US disclosed
EP-0279162-B1 CARBONIC ACID DERIVATIVES, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICALS CONTAINING THEM Roche Diagnostics GmbH (DE) 1991-06-19 EP disclosed
EP-0279162-A1 Carbonic acid derivatives, process for their preparation and pharmaceuticals containing them Roche Diagnostics GmbH (DE) 1988-08-24 EP disclosed