SCHEMBL9614197

SCHEMBL9614197

Cc1ccc(OCCOCCC(Sc2ccc(C)cc2)C(=O)O)cc1

nearest known ligand 0.71

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
PPARG P37231 16/20 0.71
PPARA Q07869 16/20 0.71
ALOX5 P09917 13/20 0.71
PTGES O14684 11/20 0.71
ALDH1A1 P00352 2/20 0.56
MAPT P10636 2/20 0.56
POLB P06746 1/20 0.56
HTT P42858 1/20 0.56
RECQL P46063 1/20 0.56
LMNA P02545 1/20 0.50
KMT2A Q03164 1/20 0.50
L3MBTL1 Q9Y468 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
SCHEMBL9614180 0.95 PPARG (0.65) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9614074 0.94 PPARG (0.64) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9613848 0.85 PPARG (0.81) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9858491 0.82 PPARG (0.75) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9857889 0.81 PPARG (0.74) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9858468 0.81 PPARG (0.74) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9613827 0.81 PPARG (0.73) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9614194 0.81 PPARG (0.53) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9614203 0.80 PPARG (0.72) PPARGPPARAALOX5PTGESALDH1A1
SCHEMBL9613814 0.80 PPARG (0.72) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5145611-A Diabetes BOEHRINGER MANNHEIM GMBH (DE) 1992-09-08 US disclosed