SCHEMBL1695777

SCHEMBL1695777

Fc1ccc(C=C(c2ccc(OCc3ccc4ccccc4n3)cc2)c2nnco2)c(F)c1

nearest known ligand 0.46

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
▸ GPBAR1 Q8TDU6 2/20 0.46
▸ PDE10A Q9Y233 11/20 0.45
▸ ALOX5 P09917 1/20 0.43
▸ CYSLTR1 Q9Y271 4/20 0.43
▸ CYSLTR2 Q9NS75 2/20 0.42
▸ PPARG P37231 1/20 0.41
▸ HTR2B P41595 1/20 0.41

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
SCHEMBL1695747 0.92 GPBAR1 (0.45) GPBAR1PDE10AALOX5CYSLTR1CYSLTR2
SCHEMBL1695749 0.92 GPBAR1 (0.45) GPBAR1PDE10AALOX5CYSLTR1CYSLTR2
SCHEMBL7704889 0.92 GPBAR1 (0.45) GPBAR1PDE10AALOX5CYSLTR1CYSLTR2
SCHEMBL1695449 0.88 GPBAR1 (0.48) GPBAR1PDE10ACYSLTR1CYSLTR2HTR2B
SCHEMBL1695447 0.88 GPBAR1 (0.48) GPBAR1PDE10ACYSLTR1CYSLTR2HTR2B
SCHEMBL7708112 0.86 GPBAR1 (0.46) GPBAR1PDE10ACYSLTR1CYSLTR2
SCHEMBL1695798 0.84 GPBAR1 (0.55) GPBAR1PDE10ACYSLTR1CYSLTR2
SCHEMBL1695716 0.84 GPBAR1 (0.55) GPBAR1PDE10ACYSLTR1CYSLTR2
SCHEMBL1695692 0.84 GPBAR1 (0.44) GPBAR1PDE10ACYSLTR1CYSLTR2
SCHEMBL1695690 0.84 GPBAR1 (0.44) GPBAR1PDE10ACYSLTR1CYSLTR2

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 claimed
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