SCHEMBL16601123

SCHEMBL16601123

Oc1ccc(CC(O)N2C[C@H]3C[C@@H](Cc4ccccc4)C[C@H]3C2)cc1F

nearest known ligand 0.62

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ GRIN2B Q13224 16/20 0.62
▸ GRIN1 Q05586 1/20 0.39

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
SCHEMBL16601159 0.83 GRIN2B (0.60) GRIN2BGRIN1
SCHEMBL16601003 0.83 GRIN2B (0.60) GRIN2BGRIN1
SCHEMBL16601043 0.78 GRIN2B (0.66) GRIN2BGRIN1
SCHEMBL16601492 0.78 GRIN2B (0.66) GRIN2BGRIN1
SCHEMBL16608162 0.76 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL16601007 0.76 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL16601009 0.76 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL16601008 0.76 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL18622657 0.76 GRIN2B (1.00) GRIN2BGRIN1
SCHEMBL5732849 0.74 GRIN2B (0.40) 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3036221-A1 SELECTIVE OCTAHYDRO-CYCLOPENTA[C]PYRROLE NEGATIVE MODULATORS OF NR2B Luc Therapeutics, Inc. (US) 2016-06-29 — — EP claimed
WO-2015048507-A1 SELECTIVE OCTAHYDRO-CYCLOPENTA[C] PYRROLE NEGATIVE MODULATORS OF NR2B MNEMOSYNE PHARMACEUTICALS, INC. (US) 2015-04-02 — — WO claimed
EP-3036221-A1 SELECTIVE OCTAHYDRO-CYCLOPENTA[C]PYRROLE NEGATIVE MODULATORS OF NR2B Luc Therapeutics, Inc. (US) 2016-06-29 — — EP disclosed
WO-2015048507-A1 SELECTIVE OCTAHYDRO-CYCLOPENTA[C] PYRROLE NEGATIVE MODULATORS OF NR2B MNEMOSYNE PHARMACEUTICALS, INC. (US) 2015-04-02 — — WO disclosed
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