SCHEMBL1503108

SCHEMBL1503108

Cn1cnc(CN(Cc2cn(C)cn2)C2Cc3ccccc3N(c3ccc4c(n3)n(C)c(=O)n4CC(C)(C)C)C2)c1

nearest known ligand 0.57

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 20/20 0.57
CYP3A4 P08684 1/20 0.38

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
SCHEMBL1503003 0.82 GRM2 (0.60) GRM2CYP3A4
SCHEMBL1503163 0.80 GRM2 (0.61) GRM2CYP3A4
SCHEMBL1502949 0.80 GRM2 (0.61) GRM2CYP3A4
SCHEMBL1503116 0.80 GRM2 (0.61) GRM2CYP3A4
SCHEMBL1502937 0.79 GRM2 (0.69) GRM2CYP3A4
SCHEMBL1503040 0.79 GRM2 (0.55) GRM2CYP3A4
SCHEMBL1503194 0.76 GRM2 (0.65) GRM2CYP3A4
SCHEMBL1503036 0.74 GRM2 (0.63) GRM2CYP3A4
SCHEMBL1503053 0.74 GRM2 (0.63) GRM2CYP3A4
SCHEMBL1503058 0.74 GRM2 (0.62) GRM2CYP3A4

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-2011034741-A1 IMIDAZOPYRIDIN-2-ONE DERIVATIVES MERCK SHARP & DOHME CORP. (US) 2011-03-24 WO claimed