SCHEMBL1695534

SCHEMBL1695534

CN(C)/C=N\C(=O)C(=Cc1ccc(Cl)cc1)c1ccc(OCc2ccc3ccccc3n2)cc1

nearest known ligand 0.52

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
▸ PDE10A Q9Y233 8/20 0.52
▸ GPBAR1 Q8TDU6 1/20 0.51
▸ ALOX5 P09917 2/20 0.48
▸ CYSLTR2 Q9NS75 8/20 0.47
▸ CYSLTR1 Q9Y271 8/20 0.47
▸ ALOX5AP P20292 1/20 0.45

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
SCHEMBL1695531 1.00 PDE10A (0.52) PDE10AGPBAR1ALOX5CYSLTR2CYSLTR1
SCHEMBL1695536 1.00 PDE10A (0.52) PDE10AGPBAR1ALOX5CYSLTR2CYSLTR1
SCHEMBL7708300 0.85 PDE10A (0.54) PDE10AGPBAR1ALOX5CYSLTR2CYSLTR1
SCHEMBL1695577 0.84 GPBAR1 (0.63) PDE10AGPBAR1ALOX5CYSLTR2CYSLTR1
SCHEMBL7703187 0.84 GPBAR1 (0.63) PDE10AGPBAR1ALOX5CYSLTR2CYSLTR1
SCHEMBL1695576 0.84 GPBAR1 (0.63) PDE10AGPBAR1ALOX5CYSLTR2CYSLTR1
SCHEMBL1695695 0.83 GPBAR1 (0.58) PDE10AGPBAR1ALOX5CYSLTR2CYSLTR1
SCHEMBL1695698 0.83 GPBAR1 (0.58) PDE10AGPBAR1ALOX5CYSLTR2CYSLTR1
SCHEMBL1695821 0.83 GPBAR1 (0.55) PDE10AGPBAR1ALOX5CYSLTR2CYSLTR1
SCHEMBL1695825 0.83 GPBAR1 (0.55) PDE10AGPBAR1ALOX5CYSLTR2CYSLTR1

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-2011138657-A1 ARYL SUBSTITUTED OLEFINIC COMPOUNDS AS PDE10A INHIBITORS GLENMARK PHARMACEUTICALS S.A. (CH) 2011-11-10 — — WO disclosed
Send feedback