SCHEMBL3124902

SCHEMBL3124902

CCCCNC(=O)Cn1c(=O)n(C)c2cc(-c3cc(F)cc(Cl)c3)cnc21

nearest known ligand 0.51

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 18/20 0.51
GRIN1 Q05586 17/20 0.51
POLB P06746 1/20 0.41
THRB P10828 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
CNR2 P34972 1/20 0.40

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
SCHEMBL13521710 0.93 GRIN1 (0.53) GRIN2BGRIN1POLBTHRBL3MBTL1
SCHEMBL3126458 0.93 GRIN2B (0.47) GRIN2BGRIN1CNR2
SCHEMBL3247757 0.91 GRIN1 (0.52) GRIN2BGRIN1POLBTHRBL3MBTL1
SCHEMBL3122850 0.87 GRIN1 (0.50) GRIN2BGRIN1POLBTHRBL3MBTL1
SCHEMBL13521717 0.86 GRIN2B (0.49) GRIN2BGRIN1POLBTHRBL3MBTL1
SCHEMBL13521623 0.86 GRIN1 (0.49) GRIN2BGRIN1POLBTHRBL3MBTL1
SCHEMBL3127427 0.85 GRIN1 (0.49) GRIN2BGRIN1POLBTHRBL3MBTL1
SCHEMBL13521608 0.84 GRIN2B (0.47) GRIN2BGRIN1POLBTHRBL3MBTL1
SCHEMBL13521743 0.84 GRIN2B (0.51) GRIN2BGRIN1CNR2
SCHEMBL3120723 0.83 GRIN2B (0.46) GRIN2BGRIN1THRBCNR2

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
WO-2010008777-A2 FUSED AZABICYCLIC PYRIDINES LIGAND PHARMACEUTICALS INC. (US) 2010-01-21 WO claimed
WO-2010008777-A2 FUSED AZABICYCLIC PYRIDINES LIGAND PHARMACEUTICALS INC. (US) 2010-01-21 WO disclosed