SCHEMBL29465731

SCHEMBL29465731

O=C(Cn1ncc2ncc(-c3ccc(Cl)c(OC(F)F)c3)nc21)N1CCC1

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 1/20 0.55

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
SCHEMBL22772890 1.00 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL29465733 0.90 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL22772827 0.90 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL22772853 0.85 GRIN2B (1.00) GRIN2B
SCHEMBL29465723 0.85 GRIN2B (1.00) GRIN2B
SCHEMBL22772882 0.84 GRIN2B (1.00) GRIN2B
SCHEMBL29465726 0.84 GRIN2B (1.00) GRIN2B
SCHEMBL22775884 0.84 GRIN2B (0.72) GRIN2BGRIN1
SCHEMBL29550480 0.84 GRIN2B (0.72) GRIN2BGRIN1
SCHEMBL22772864 0.81 GRIN2B (1.00) GRIN2B

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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