SCHEMBL757560

SCHEMBL757560

CCC(CCO)c1cn(CCc2ccc3c(-c4ccccc4)cc(C#N)nc3c2)nn1

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 18/20 0.46
▸ HAT1 O14929 2/20 0.31
▸ EP300 Q09472 2/20 0.31

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
SCHEMBL757559 0.80 GRM2 (0.58) GRM2
SCHEMBL756538 0.79 GRM2 (0.73) GRM2
SCHEMBL756539 0.79 GRM2 (0.73) GRM2
SCHEMBL759127 0.75 GRM2 (0.58) GRM2
SCHEMBL756814 0.71 GRM2 (0.69) GRM2
SCHEMBL756852 0.71 GRM2 (0.54) GRM2
SCHEMBL757025 0.71 GRM2 (0.86) GRM2
SCHEMBL757024 0.71 GRM2 (0.86) GRM2
SCHEMBL757530 0.68 GRM2 (0.53) GRM2
SCHEMBL2003171 0.67 GRM2 (0.51) GRM2

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
EP-2118093-B1 [1,2,3]TRIAZOLYL SUBSTITUTED QUINOLINES AND COUMARINS AS INHIBITORS OF LEUKOTRIENE BIOSYNTHESIS MERCK CANADA INC (CA) 2012-03-21 — — EP claimed
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