SCHEMBL9614217

SCHEMBL9614217

CSCCCCCCC(Sc1ccc(C)cc1)C(=O)O

nearest known ligand 0.57

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PPARG P37231 12/20 0.57
PPARA Q07869 11/20 0.57
ALOX5 P09917 10/20 0.57
PTGES O14684 7/20 0.57
ALDH1A1 P00352 3/20 0.54
MAPT P10636 3/20 0.54
KMT2A Q03164 3/20 0.54
LMNA P02545 1/20 0.54
MEN1 O00255 2/20 0.48
ATM Q13315 1/20 0.48
MMP2 P08253 1/20 0.46
MMP9 P14780 1/20 0.46
NPSR1 Q6W5P4 1/20 0.46
HTT P42858 2/20 0.44
POLB P06746 1/20 0.44
RECQL P46063 1/20 0.44
FOLH1 Q04609 1/20 0.39

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
SCHEMBL9858577 0.83 PPARG (0.58) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9614105 0.82 PPARG (0.63) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL10419970 0.81 ALOX5 (0.55) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL10419418 0.81 ALOX5 (0.55) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9613848 0.81 PPARG (0.81) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL10420221 0.81 ALOX5 (0.55) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9613827 0.79 PPARG (0.73) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL20886629 0.79 PPARG (0.66) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL10419188 0.78 PPARG (0.52) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9695329 0.78 PPARG (0.52) PPARGPPARAALOX5PTGESALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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