SCHEMBL758394

SCHEMBL758394

CC[C@](O)(c1cn(Cc2ccc3c(-c4ccc(F)cc4)cc(C(N)=O)nc3c2)nn1)C(F)(F)F

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GRM2 Q14416 20/20 1.00
▸ GRM3 Q14832 1/20 0.74

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
SCHEMBL757045 1.00 GRM2 (1.00) GRM2GRM3
SCHEMBL757557 0.93 GRM2 (0.88) GRM2GRM3
SCHEMBL759046 0.93 GRM2 (0.88) GRM2GRM3
SCHEMBL758234 0.93 GRM2 (0.88) GRM2GRM3
SCHEMBL757558 0.93 GRM2 (0.88) GRM2GRM3
SCHEMBL759522 0.93 GRM2 (1.00) GRM2GRM3
SCHEMBL757222 0.93 GRM2 (1.00) GRM2GRM3
SCHEMBL756591 0.93 GRM2 (1.00) GRM2GRM3
SCHEMBL757250 0.93 GRM2 (1.00) GRM2GRM3
SCHEMBL758519 0.93 GRM2 (1.00) GRM2GRM3

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 disclosed
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