SCHEMBL4736807

SCHEMBL4736807

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

nearest known ligand 0.43

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PTGDR2 Q9Y5Y4 1/20 0.43
PPARA Q07869 11/20 0.41
PPARG P37231 8/20 0.41
HRH3 Q9Y5N1 2/20 0.39
PPARD Q03181 8/20 0.39
MMP1 P03956 1/20 0.38
PDPK1 O15530 1/20 0.37
ALDH1A1 P00352 1/20 0.37
MAPT P10636 1/20 0.37
PTPN1 P18031 1/20 0.36

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
SCHEMBL14146245 0.88 HRH3 (0.37) PTGDR2PPARAPPARGHRH3PPARD
SCHEMBL217980 0.84 PPARA (0.41) PTGDR2PPARAPPARGPPARD
SCHEMBL4737403 0.82 PTGDR2 (0.42) PTGDR2PPARAPPARGPPARD
SCHEMBL4739636 0.82 PPARA (0.55) PPARAPPARGPPARDALDH1A1MAPT
SCHEMBL4737303 0.81 PPARA (0.48) PTGDR2PPARAPPARGPPARDALDH1A1
SCHEMBL4741103 0.80 PPARG (0.42) PTGDR2PPARAPPARGPPARD
SCHEMBL4737604 0.80 PPARD (0.45) PTGDR2PPARAPPARGPPARDMMP1
SCHEMBL4738549 0.77 PPARG (0.40) PTGDR2PPARAPPARGPPARD
SCHEMBL4739015 0.76 CYP1A1 (0.50) PTGDR2
SCHEMBL4739013 0.76 CYP1A1 (0.50) PTGDR2

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 3 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 claimed
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