SCHEMBL29604686

SCHEMBL29604686

O=C(Cn1ncc2ncc(-c3cccc(C(F)F)c3)cc21)C1CC1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 20/20 0.64
▸ GRIN1 Q05586 3/20 0.58

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
SCHEMBL22771472 1.00 GRIN2B (0.64) GRIN2BGRIN1
SCHEMBL22771416 0.87 GRIN2B (0.70) GRIN2BGRIN1
SCHEMBL29604053 0.87 GRIN2B (0.70) GRIN2BGRIN1
SCHEMBL22771411 0.85 GRIN2B (0.63) GRIN2BGRIN1
SCHEMBL22771480 0.84 GRIN2B (0.70) GRIN2BGRIN1
SCHEMBL22771458 0.84 GRIN2B (0.62) GRIN2BGRIN1
SCHEMBL29603853 0.84 GRIN2B (0.70) GRIN2BGRIN1
SCHEMBL22771386 0.84 GRIN1 (0.63) GRIN2BGRIN1
SCHEMBL22771391 0.84 GRIN1 (0.60) GRIN2BGRIN1
SCHEMBL29604133 0.84 GRIN1 (0.60) GRIN2BGRIN1

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-3983073-A1 SUBSTITUTED PYRAZOLO[4,3-B]PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 — — EP claimed
EP-3983073-A1 SUBSTITUTED PYRAZOLO[4,3-B]PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 — — EP disclosed
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