SCHEMBL6503685

SCHEMBL6503685

CO/N=C(\C)C(Cc1ccc(OCCc2ccc(OS(C)(=O)=O)cc2)cc1)C(=O)O

nearest known ligand 0.62

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 20/20 0.62
PPARG P37231 17/20 0.62
PPARD Q03181 2/20 0.45

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
SCHEMBL6503690 1.00 PPARA (0.62) PPARAPPARGPPARD
SCHEMBL6512783 0.94 PPARG (0.61) PPARAPPARG
SCHEMBL6512788 0.94 PPARG (0.61) PPARAPPARG
SCHEMBL6503508 0.89 PPARG (0.66) PPARAPPARG
SCHEMBL6505630 0.89 PPARG (0.61) PPARAPPARG
SCHEMBL6506097 0.89 PPARG (0.61) PPARAPPARG
SCHEMBL6506535 0.88 PPARG (0.58) PPARAPPARG
SCHEMBL6506532 0.88 PPARG (0.58) PPARAPPARG
SCHEMBL6512791 0.86 PPARA (0.54) PPARAPPARGPPARD
SCHEMBL6505273 0.86 PPARA (0.60) PPARAPPARG

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
WO-2005040127-A1 NOVEL COMPOUNDS AS AGONIST FOR PPAR GAMMA AND PPAR ALPHA, METHOD FOR PREPARATION OF THE SAME, AND PHARMACEUTICAL COMPOSITION CONTAINING THE SAME LG LIFE SCIENCES LTD. (KR) 2005-05-06 WO disclosed