SCHEMBL11959191

SCHEMBL11959191

CCCCn1ccc(N2CCN(c3ncc(C4CC4)cn3)CC2)c(N)c1=O

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 18/20 0.52
CYP19A1 P11511 1/20 0.34
GPR119 Q8TDV5 1/20 0.34

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
SCHEMBL14865225 0.85 GRM2 (0.70) GRM2
SCHEMBL8166648 0.71 GRM2 (0.59) GRM2
Jnj-40411813 SCHEMBL1035416 0.68 GRM2 (1.00) GRM2
SCHEMBL8160368 0.67 GRM2 (0.77) GRM2
SCHEMBL8154462 0.67 GRM2 (0.48) GRM2
SCHEMBL8167879 0.67 GRM2 (0.78) GRM2
SCHEMBL8157875 0.67 GRM2 (0.52) GRM2
SCHEMBL8156100 0.67 GRM2 (0.63) GRM2
SCHEMBL24967957 0.66 HTR3A (0.47)
SCHEMBL171886 0.66 GRM2 (0.71) 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-1994004-B1 1,4-DISUBSTITUTED 3-CYANO-PYRIDONE DERIVATIVES AND THEIR USE AS POSITIVE ALLOSTERIC MODULATORS OF MGLUR2-RECEPTORS JANSSEN PHARMACEUTICALS INC (US) 2012-08-01 EP disclosed