SCHEMBL29550464

SCHEMBL29550464

O=C(Cn1ncc2ncc(-c3ccc(F)c(C(F)(F)F)c3)cc21)N1CC(F)(F)C1

nearest known ligand 0.74

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 20/20 0.74
▸ GRIN1 Q05586 5/20 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
SCHEMBL22775605 1.00 GRIN2B (0.74) GRIN2BGRIN1
SCHEMBL22775427 0.89 GRIN2B (0.71) GRIN2BGRIN1
SCHEMBL29550729 0.89 GRIN2B (0.71) GRIN2BGRIN1
SCHEMBL22775201 0.87 GRIN2B (0.73) GRIN2BGRIN1
SCHEMBL29551071 0.87 GRIN2B (0.73) GRIN2BGRIN1
SCHEMBL22775584 0.87 GRIN2B (0.60) GRIN2BGRIN1
Trifluoroacetic Acid SCHEMBL29550660 0.86 GRIN2B (0.67) GRIN2BGRIN1
SCHEMBL29550913 0.85 GRIN2B (0.70) GRIN2B
SCHEMBL22775906 0.85 GRIN2B (0.70) GRIN2B
SCHEMBL18363243 0.85 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-3983075-A1 SUBSTITUTED PYRAZOLO-PYRIDINE AMIDES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 — — EP claimed
EP-3983075-A1 SUBSTITUTED PYRAZOLO-PYRIDINE AMIDES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 — — EP disclosed
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