SCHEMBL4739030

SCHEMBL4739030

CCC(Oc1ccc(CCC(OCc2ccc(Br)cc2)c2ccc(C(F)(F)F)cc2)c(Cl)c1Cl)C(=O)O

nearest known ligand 0.39

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 10/20 0.39
FFAR1 O14842 3/20 0.39
PPARA Q07869 13/20 0.37
PTGDR2 Q9Y5Y4 1/20 0.36
PPARD Q03181 7/20 0.35
PTGER1 P34995 1/20 0.34
MDM2 Q00987 1/20 0.33

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
SCHEMBL4739883 0.93 PTGDR2 (0.38) PPARGFFAR1PPARAPTGDR2PPARD
SCHEMBL4738549 0.92 PPARG (0.40) PPARGFFAR1PPARAPTGDR2PPARD
SCHEMBL4740249 0.92 PPARG (0.39) PPARGFFAR1PPARAPTGDR2PPARD
SCHEMBL14146308 0.90 FFAR1 (0.35) PPARGFFAR1PPARAPPARDPTGER1
SCHEMBL4741103 0.88 PPARG (0.42) PPARGFFAR1PPARAPTGDR2PPARD
SCHEMBL14146304 0.84 PPARG (0.36) PPARGFFAR1PPARAPPARD
SCHEMBL14146302 0.83 UTS2R (0.32) PPARGFFAR1PPARAPPARD
SCHEMBL14146648 0.82 FFAR1 (0.35) PPARGFFAR1PPARAPPARD
SCHEMBL4737403 0.81 PTGDR2 (0.42) PPARGPPARAPTGDR2PPARD
SCHEMBL4736807 0.74 PTGDR2 (0.43) PPARGPPARAPTGDR2PPARD

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-2008087365-A2 SUBSTITUTED 1, 3-DIPHENYLPROPANE DERIVATIVES, PREPARATIONS AND USES OF SAME GENFIT (FR) 2008-07-24 WO disclosed
WO-2008087365-A2 SUBSTITUTED 1, 3-DIPHENYLPROPANE DERIVATIVES, PREPARATIONS AND USES OF SAME GENFIT (FR) 2008-07-24 WO disclosed