SCHEMBL2464977

SCHEMBL2464977

CCC(Oc1ccc(C(=O)C=Cc2sc(-c3ccc(C(F)(F)F)cc3)nc2C(C)C)cc1C)C(=O)O

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PPARD Q03181 19/20 0.56
PPARA Q07869 16/20 0.56
PPARG P37231 8/20 0.44
PTGDR2 Q9Y5Y4 1/20 0.40

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
SCHEMBL12648504 0.86 PPARD (0.56) PPARDPPARAPPARG
SCHEMBL1765829 0.86 PPARD (0.56) PPARDPPARAPPARG
SCHEMBL30003645 0.85 PPARD (0.45) PPARDPPARAPPARG
SCHEMBL12648327 0.85 PPARA (0.54) PPARDPPARAPPARG
SCHEMBL2463761 0.85 PPARA (0.54) PPARDPPARAPPARG
SCHEMBL2464436 0.85 PPARD (0.45) PPARDPPARAPPARG
SCHEMBL12732422 0.85 PPARD (0.50) PPARDPPARAPPARG
SCHEMBL30002894 0.84 PPARD (0.44) PPARDPPARAPPARG
SCHEMBL12732418 0.83 PPARD (0.47) PPARDPPARAPPARG
SCHEMBL2463948 0.82 CYP1A1 (0.41) PPARDPPARAPPARG

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
EP-1424330-B1 ACTIVATOR FOR PEROXISOME PROLIFERATOR-RESPONSIVE RECEPTOR DELTA NIPPON CHEMIPHAR CO (JP) 2011-09-28 EP disclosed