SCHEMBL4739835

SCHEMBL4739835

O=C(/C=C/c1ccc(O)c(Cl)c1Cl)c1cc(F)cc(C(F)(F)F)c1

nearest known ligand 0.51

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CYP1A1 P04798 9/20 0.49
CYP1B1 Q16678 9/20 0.49
DPP4 P27487 1/20 0.45
CXCL12 P48061 1/20 0.40
MAOB P27338 3/20 0.40
P4HB P07237 2/20 0.39
MAPT P10636 1/20 0.39
SNCA P37840 1/20 0.39
CHRNA7 P36544 1/20 0.38

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
SCHEMBL4739838 1.00 CYP1A1 (0.49) CYP1A1CYP1B1DPP4CXCL12MAOB
SCHEMBL4737441 0.83 CYP1A1 (0.58) CYP1A1CYP1B1DPP4CXCL12MAOB
SCHEMBL4737444 0.83 CYP1A1 (0.58) CYP1A1CYP1B1DPP4CXCL12MAOB
SCHEMBL14146094 0.81 CHRNA7 (0.39) CYP1A1CYP1B1DPP4CXCL12MAPT
SCHEMBL4736808 0.80 TNFRSF1A (0.46) CYP1A1CYP1B1DPP4MAOB
SCHEMBL4736804 0.80 TNFRSF1A (0.46) CYP1A1CYP1B1DPP4MAOB
SCHEMBL4736818 0.72 GABRA3 (0.47) CYP1A1CYP1B1DPP4MAOBP4HB
SCHEMBL4736824 0.72 GABRA3 (0.47) CYP1A1CYP1B1DPP4MAOBP4HB
SCHEMBL216812 0.71 MAOA (0.42) CYP1A1CYP1B1DPP4CXCL12MAOB
SCHEMBL216811 0.71 MAOA (0.42) CYP1A1CYP1B1DPP4CXCL12MAOB

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