SCHEMBL29465752

SCHEMBL29465752

COc1cncc(Cn2ncc3ncc(-c4ccc(F)c(C(F)F)c4)nc32)c1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 20/20 1.00
▸ GRIN1 Q05586 8/20 0.71

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
SCHEMBL22772892 1.00 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL22772824 0.88 GRIN2B (0.79) GRIN2BGRIN1
SCHEMBL29465728 0.88 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL22772842 0.88 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL22772825 0.87 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL29465736 0.87 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL22787202 0.85 GRIN2B (0.78) GRIN2BGRIN1
SCHEMBL22772883 0.83 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL22775088 0.83 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL29525257 0.83 GRIN2B (1.00) 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-3983413-A1 SUBSTITUTED PYRAZOLO-PYRAZINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 — — EP claimed
EP-3983413-A1 SUBSTITUTED PYRAZOLO-PYRAZINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 — — EP disclosed
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