SCHEMBL24136404

SCHEMBL24136404

N[C@]12CCC[C@H]1CN(CC(=O)c1ccc(N=O)cn1)C2

nearest known ligand 0.37

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 20/20 0.37
GRIN1 Q05586 5/20 0.33

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
SCHEMBL24136445 0.86 GRIN2B (0.50) GRIN2BGRIN1
SCHEMBL24270944 0.77
SCHEMBL22239239 0.76 GRIN2B (0.49) GRIN2BGRIN1
SCHEMBL22239252 0.74 GRIN2B (0.40) GRIN2BGRIN1
SCHEMBL26020473 0.74 GRIN2B (0.47) GRIN2BGRIN1
SCHEMBL22239269 0.73 KMT2A (0.46) GRIN2B
SCHEMBL22239272 0.73 KDM4E (0.35) GRIN2BGRIN1
SCHEMBL24270860 0.70
SCHEMBL24270830 0.68 GRIN2B (0.48) GRIN2BGRIN1
SCHEMBL24271025 0.67 GRIN2B (0.40) 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