SCHEMBL5545733

SCHEMBL5545733

CCCCCOc1ccc2[nH]ccc2c1.CCCc1c(OCCCCOc2ccc(-c3nnn[nH]3)cc2)ccc2c1ccn2CC(C)(C)C

nearest known ligand 0.59

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 20/20 0.59

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
SCHEMBL1995376 0.89 GRM2 (0.73) GRM2
SCHEMBL1999842 0.88 GRM2 (0.73) GRM2
SCHEMBL1997997 0.87 GRM2 (0.73) GRM2
SCHEMBL1993643 0.87 GRM2 (0.72) GRM2
SCHEMBL1997085 0.78 GRM2 (0.67) GRM2
SCHEMBL1996720 0.78 GRM2 (0.71) GRM2
SCHEMBL1998075 0.77 GRM2 (0.69) GRM2
SCHEMBL1999981 0.77 GRM2 (0.71) GRM2
SCHEMBL1994588 0.77 GRM2 (0.57) GRM2
SCHEMBL1996622 0.77 GRM2 (0.73) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1855670-A2 BENZAZOLE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS Merck & Co., Inc. (US) 2007-11-21 EP disclosed
WO-2006091496-A2 BENZAZOLE POTENTIATORS OF METABOTROPIC GLUTAMATE RECEPTORS MERCK & CO., INC. (US) 2006-08-31 WO disclosed