SCHEMBL8155128

SCHEMBL8155128

COc1ccn(CCC2CC2)c(=O)c1N

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
GRM2 Q14416 4/20 0.39
LCK P06239 1/20 0.39
KIT P10721 1/20 0.39
SRC P12931 1/20 0.39
KDR P35968 1/20 0.39
CECR2 Q9BXF3 1/20 0.39
ACHE P22303 4/20 0.38
BRD9 Q9H8M2 1/20 0.37
NPSR1 Q6W5P4 1/20 0.35
HTR4 Q13639 3/20 0.35
PDE4B Q07343 2/20 0.34
PIK3CA P42336 1/20 0.34
LMNA P02545 1/20 0.34
MAPT P10636 1/20 0.34
CYP2C9 P11712 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
SCHEMBL8154473 0.85 GRM2 (0.45) GRM2PDE4BPIK3CA
SCHEMBL1828011 0.80 LMNA (0.57) GRM2CECR2LMNAMAPTCYP2C9
SCHEMBL8160720 0.78 TNF (0.41) GRM2BRD9NPSR1PDE4BLMNA
SCHEMBL8154793 0.78 GRM2 (0.42) GRM2LCKKITSRCKDR
SCHEMBL8146318 0.78 GRM2 (0.41) GRM2LCKKITSRCKDR
SCHEMBL1827372 0.65 GRM2 (0.61) GRM2LMNAMAPTCYP2C9
SCHEMBL24363726 0.64 CECR2 (0.46) GRM2LCKKITSRCKDR
SCHEMBL4682912 0.64 GRM2 (0.36) GRM2LCKKITSRCKDR
SCHEMBL4683778 0.64 GRM2 (0.36) GRM2LCKKITSRCKDR
SCHEMBL4682908 0.64 GRM2 (0.36) GRM2LCKKITSRCKDR

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-2134708-B1 3-CYANO-4-(4-TETRAHYDROPYRAN-PHENYL)-PYRIDIN-2-ONE DERIVATIVES ORTHO MCNEIL JANSSEN PHARM (US) 2011-05-11 EP disclosed
WO-2008107481-A1 3-CYANO-4-(4-TETRAHYDROPYRAN-PHENYL)-PYRIDIN-2-ONE DERIVATIVES ORTHO-MCNEIL-JANSSEN PHARMACEUTICALS, INC (US) 2008-09-12 WO disclosed