SCHEMBL29524730

SCHEMBL29524730

Cc1nnc(Cn2ncc3ncc(-c4ccc(C(F)(F)F)s4)cc32)o1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 20/20 1.00
GRIN2B Q13224 20/20 1.00

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
SCHEMBL22775114 1.00 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL22774549 0.85 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL22774366 0.84 GRIN2B (1.00) GRIN1GRIN2B
SCHEMBL22774846 0.81 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL29525343 0.81 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL29525310 0.79 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL22774548 0.79 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL20134436 0.79 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL22774636 0.78 GRIN1 (1.00) GRIN1GRIN2B
SCHEMBL22788326 0.77 GRIN1 (1.00) GRIN1GRIN2B

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-3982958-A1 SUBSTITUTED HETEROAROMATIC PYRAZOLO-PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 EP claimed
EP-3982958-A1 SUBSTITUTED HETEROAROMATIC PYRAZOLO-PYRIDINES AND THEIR USE AS GLUN2B RECEPTOR MODULATORS Janssen Pharmaceutica NV (BE) 2022-04-20 EP disclosed