SCHEMBL171830

SCHEMBL171830

CCCc1ccc(-c2ccn(CCC(C)C)c(=O)c2C#N)cc1

nearest known ligand 0.74

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 20/20 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
SCHEMBL101094 0.88 GRM2 (0.71) GRM2
SCHEMBL13232289 0.86 GRM2 (0.71) GRM2
SCHEMBL171929 0.85 GRM2 (1.00) GRM2
SCHEMBL101605 0.85 GRM2 (0.77) GRM2
SCHEMBL13232286 0.84 GRM2 (0.69) GRM2
SCHEMBL100668 0.84 GRM2 (0.71) GRM2
SCHEMBL101093 0.83 GRM2 (0.69) GRM2
SCHEMBL171270 0.81 GRM2 (0.68) GRM2
SCHEMBL103205 0.79 GRM2 (1.00) GRM2
SCHEMBL11959885 0.79 GRM2 (0.70) 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-2426125-A1 1,4 disubstituted 3 cyano pyridone derivatives and their use as positive allosteric modulators of mGluR2 receptors Ortho-McNeil-Janssen Pharmaceuticals, Inc. (US) 2012-03-07 EP disclosed