SCHEMBL4741113

SCHEMBL4741113

Cc1csc(C(=O)C=Cc2ccc(O)c(Cl)c2Cl)c1

nearest known ligand 0.60

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
KDR P35968 10/20 0.60
DAO P14920 1/20 0.41
CTSL P07711 1/20 0.40
MAOA P21397 1/20 0.39
MAOB P27338 1/20 0.39

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
SCHEMBL216812 0.77 MAOA (0.42) KDRCTSLMAOAMAOB
SCHEMBL216811 0.77 MAOA (0.42) KDRCTSLMAOAMAOB
SCHEMBL4461043 0.74 SNCA (0.52) KDRMAOAMAOB
SCHEMBL3969210 0.72 APP (0.51) KDRMAOAMAOB
SCHEMBL21219011 0.71 CYP1A2 (0.56) KDRDAO
SCHEMBL499507 0.71 CYP1A2 (0.56) KDRDAO
SCHEMBL16048819 0.70 CA1 (0.53)
SCHEMBL16048816 0.70 CA1 (0.53)
SCHEMBL18551815 0.70 MAOA (0.51) KDRDAOMAOAMAOB
SCHEMBL6781413 0.70 KDR (0.52) KDRDAO

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