SCHEMBL13735528

SCHEMBL13735528

Cc1cccc(C#Cc2ccc(N3C(=O)C(C)CN3C)nc2)c1.Cc1cccc(C#Cc2ccc(N3C(=O)CC(C)(C)N3C)nc2)c1

nearest known ligand 0.53

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
GRM5 P41594 20/20 0.53

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
SCHEMBL13518147 0.90 GRM5 (0.64) GRM5
SCHEMBL13518491 0.80 GRM5 (0.68) GRM5
SCHEMBL13518656 0.79 GRM5 (0.64) GRM5
SCHEMBL13518736 0.78 GRM5 (0.61) GRM5
SCHEMBL13519225 0.73 GRM5 (0.55) GRM5
SCHEMBL13559661 0.72 PGR (0.41) GRM5
SCHEMBL13518156 0.70 GRM5 (0.59) GRM5
SCHEMBL2518400 0.70 GRM5 (1.00) GRM5
SCHEMBL13518154 0.67 GRM5 (0.67) GRM5
SCHEMBL2516878 0.67 GRM5 (1.00) GRM5

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-2702050-A1 PYRAZOLIDIN-3-ONE DERIVATIVES F.HOFFMANN-LA ROCHE AG (CH) 2014-03-05 EP disclosed
WO-2012146552-A1 PYRAZOLIDIN-3-ONE DERIVATIVES F. HOFFMANN-LA ROCHE AG (CH) 2012-11-01 WO disclosed