SCHEMBL4741103

SCHEMBL4741103

CCOC(CCc1ccc(OC(CC)C(=O)O)c(Cl)c1Cl)c1ccc(C(F)(F)F)cc1

nearest known ligand 0.42

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
PPARG P37231 8/20 0.42
FFAR1 O14842 4/20 0.42
PTGDR2 Q9Y5Y4 1/20 0.40
PPARA Q07869 10/20 0.39
PPARD Q03181 6/20 0.37
UTS2R Q9UKP6 2/20 0.36
SLC6A9 P48067 2/20 0.35

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
SCHEMBL4738549 0.90 PPARG (0.40) PPARGFFAR1PTGDR2PPARAPPARD
SCHEMBL4740249 0.88 PPARG (0.39) PPARGFFAR1PTGDR2PPARAPPARD
SCHEMBL4739030 0.88 PPARG (0.39) PPARGFFAR1PTGDR2PPARAPPARD
SCHEMBL4737403 0.87 PTGDR2 (0.42) PPARGPTGDR2PPARAPPARDUTS2R
SCHEMBL4739883 0.87 PTGDR2 (0.38) PPARGFFAR1PTGDR2PPARAPPARD
SCHEMBL4739586 0.81 PPARD (0.45) PPARGPPARAPPARD
SCHEMBL14146304 0.81 PPARG (0.36) PPARGFFAR1PPARAPPARDUTS2R
SCHEMBL4736807 0.80 PTGDR2 (0.43) PPARGPTGDR2PPARAPPARD
SCHEMBL14146096 0.79 FFAR1 (0.42) PPARGFFAR1PPARAUTS2RSLC6A9
SCHEMBL14146648 0.78 FFAR1 (0.35) PPARGFFAR1PPARAPPARDUTS2R

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