SCHEMBL4739677

SCHEMBL4739677

CC(C)c1nc(-c2ccc(C(F)(F)F)cc2)sc1C(=O)C=Cc1ccc(OC(C)(C)C(=O)O)c(Br)c1

nearest known ligand 0.49

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
PPARA Q07869 18/20 0.49
PPARD Q03181 15/20 0.49
PPARG P37231 10/20 0.49
FFAR1 O14842 1/20 0.38
TNFRSF1A P19438 1/20 0.37

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
SCHEMBL4739674 1.00 PPARA (0.49) PPARAPPARDPPARGFFAR1TNFRSF1A
SCHEMBL14146386 0.91 PPARA (0.41) PPARAPPARDPPARGFFAR1
SCHEMBL4741598 0.85 CXCL12 (0.42) PPARAPPARDPPARGFFAR1
SCHEMBL4741599 0.85 CXCL12 (0.42) PPARAPPARDPPARGFFAR1
SCHEMBL2463947 0.79 MAPT (0.43) PPARAPPARDPPARGFFAR1
SCHEMBL2464435 0.78 PPARD (0.44) PPARAPPARDPPARGFFAR1
SCHEMBL2463761 0.76 PPARA (0.54) PPARAPPARDPPARGTNFRSF1A
SCHEMBL12648327 0.76 PPARA (0.54) PPARAPPARDPPARGTNFRSF1A
SCHEMBL2464492 0.76 PPARD (0.61) PPARAPPARDPPARG
SCHEMBL12648524 0.76 PPARD (0.61) PPARAPPARDPPARG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008087367-A2 SUBSTITUTED (PHENYLTHIAZOLYL)-PHENYL-PROPAN-1-ONE AND (PHENYLOXAZODYL)-PHENYL-PROPAN-1-ONE DERIVATIVES, PREPARATIONS AND USES OF SAME GENFIT (FR) 2008-07-24 WO claimed
WO-2008087367-A2 SUBSTITUTED (PHENYLTHIAZOLYL)-PHENYL-PROPAN-1-ONE AND (PHENYLOXAZODYL)-PHENYL-PROPAN-1-ONE DERIVATIVES, PREPARATIONS AND USES OF SAME GENFIT (FR) 2008-07-24 WO disclosed