SCHEMBL1423588

SCHEMBL1423588

N#Cc1cc(OCc2ccc3ccccc3n2)cc(-c2ccncc2)c1-c1ccccc1

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PDE10A Q9Y233 11/20 0.52
ALOX5 P09917 1/20 0.49
LGALS3 P17931 1/20 0.49
PDE4D Q08499 1/20 0.49
CYSLTR2 Q9NS75 1/20 0.49
CYSLTR1 Q9Y271 1/20 0.49
GPBAR1 Q8TDU6 1/20 0.47
CYP1A2 P05177 1/20 0.47

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
SCHEMBL1423701 0.84 PDE10A (0.60) PDE10ALGALS3PDE4DCYSLTR2CYSLTR1
SCHEMBL1423576 0.84 PDE10A (0.60) PDE10ALGALS3PDE4DCYSLTR2CYSLTR1
SCHEMBL1423592 0.82 PDE10A (0.48) PDE10ALGALS3PDE4DCYSLTR2CYSLTR1
SCHEMBL1423860 0.82 PDE10A (0.52) PDE10AALOX5LGALS3PDE4DCYSLTR2
SCHEMBL27816170 0.78 PDE10A (0.48) PDE10ALGALS3PDE4DCYSLTR2CYSLTR1
SCHEMBL1423737 0.77 PDE10A (0.62) PDE10ALGALS3PDE4DCYSLTR2CYSLTR1
SCHEMBL1423901 0.77 PDE10A (0.62) PDE10ALGALS3PDE4DCYSLTR2CYSLTR1
SCHEMBL1423674 0.75 PDE10A (0.71) PDE10ALGALS3PDE4DCYSLTR2CYSLTR1
SCHEMBL2564073 0.75 PDE10A (0.60) PDE10ALGALS3PDE4DCYSLTR2CYSLTR1
SCHEMBL28791816 0.73 GPBAR1 (0.49) PDE10ACYSLTR2CYSLTR1GPBAR1

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
CN-102131798-A Di-substituted phenyl compounds used as inhibitors of phosphodiesterase 10 ENVIVO PHARMACEUTICALS INC 2011-07-20 CN disclosed
EP-2297131-A2 DI-SUBSTITUTED PHENYL COMPOUNDS AS PHOSPHODIESTERASE 10 INHIBITORS Envivo Pharmaceuticals, Inc. (US) 2011-03-23 EP disclosed
WO-2009158467-A2 DI-SUBSTITUTED PHENYL COMPOUNDS ENVIVO PHARMACEUTICALS, INC. (US) 2009-12-30 WO disclosed