SCHEMBL10146378

SCHEMBL10146378

Cn1c(=O)n(CC(C)(C)C)c2ccc(-c3cccnc3N)cc21

nearest known ligand 0.61

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 18/20 0.61
METAP2 P50579 1/20 0.46
PARG Q86W56 1/20 0.42

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
SCHEMBL14992229 0.86 GRM2 (0.61) GRM2METAP2PARG
SCHEMBL14993300 0.84 GRM2 (0.59) GRM2METAP2PARG
SCHEMBL10145933 0.84 GRM2 (0.58) GRM2PARG
SCHEMBL10145855 0.84 GRM2 (0.60) GRM2PARG
SCHEMBL10146668 0.83 GRM2 (0.70) GRM2METAP2PARG
SCHEMBL10145935 0.83 GRM2 (0.70) GRM2PARG
SCHEMBL10146587 0.81 METAP2 (0.46) GRM2METAP2
SCHEMBL10146639 0.81 GRM2 (0.62) GRM2PARG
SCHEMBL10146385 0.81 GRM2 (0.62) GRM2PARG
SCHEMBL10145951 0.80 GRM2 (0.65) GRM2PARG

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-2012021382-A1 POSITIVE ALLOSTERIC MODULATORS OF MGLUR2 MERCK SHARP & DOHME CORP. (US) 2012-02-16 WO disclosed