SCHEMBL24136395

SCHEMBL24136395

Oc1ccc(CCN2CC3CC(Oc4ccc(F)cc4)CC3C2)cc1

nearest known ligand 0.64

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRIN1 Q05586 20/20 0.64
GRIN2B Q13224 20/20 0.64

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
SCHEMBL20090966 1.00 GRIN1 (0.64) GRIN1GRIN2B
SCHEMBL20091039 0.94 GRIN1 (0.58) GRIN1GRIN2B
SCHEMBL20090920 0.88 GRIN1 (0.64) GRIN1GRIN2B
SCHEMBL22701632 0.88 GRIN1 (0.64) GRIN1GRIN2B
SCHEMBL17643471 0.87 GRIN1 (0.62) GRIN1GRIN2B
SCHEMBL22701654 0.87 GRIN1 (0.66) GRIN1GRIN2B
SCHEMBL20090908 0.87 GRIN1 (0.66) GRIN1GRIN2B
SCHEMBL21018201 0.86 GRIN1 (0.64) GRIN1GRIN2B
SCHEMBL21018536 0.85 GRIN1 (0.64) GRIN1GRIN2B
SCHEMBL20091024 0.85 GRIN1 (0.67) 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 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