SCHEMBL24136351

SCHEMBL24136351

COc1cccc(OC2CC3CN(CC(=O)c4ccc(O)cn4)CC3C2)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 19/20 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
SCHEMBL17643083 1.00 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL22228171 1.00 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL29882746 1.00 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL24136448 1.00 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL20983483 1.00 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL20086362 0.90 GRIN1 (0.82) GRIN2BGRIN1
SCHEMBL20983408 0.90 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL24136342 0.90 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL17643094 0.90 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL29882741 0.90 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3683207-B1 N-ALKYLARYL-5-OXYARYL-OCTAHYDRO-CYCLOPENTA[C]PYRROLE NEGATIVE ALLOSTERIC MODULATORS OF NR2B CADENT THERAPEUTICS INC (US) 2021-12-29 EP disclosed