SCHEMBL19853750

SCHEMBL19853750

C[C@@H](O)[C@@H](C(=O)O)N1CC2(CCC(N)CC2)C1=O

nearest known ligand 0.36

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.36
GRIN2C Q14957 1/20 0.36

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
SCHEMBL19853754 0.89 GRIN2B (0.46) GRIN2BGRIN2C
SCHEMBL24634210 0.87 GRIN2B (0.34) GRIN2BGRIN2C
SCHEMBL19839353 0.87 GRIN2B (0.34) GRIN2BGRIN2C
SCHEMBL19839355 0.87 GRIN2B (0.34) GRIN2BGRIN2C
SCHEMBL19839379 0.84 GRIN2B (0.38) GRIN2BGRIN2C
SCHEMBL19839374 0.84 GRIN2B (0.38) GRIN2BGRIN2C
SCHEMBL19839370 0.77 GRIN2B (0.46) GRIN2BGRIN2C
SCHEMBL19839385 0.77 GRIN2B (0.46) GRIN2BGRIN2C
SCHEMBL19854372 0.77 GRIN2B (0.46) GRIN2BGRIN2C
SCHEMBL19839367 0.77 GRIN2B (0.46) GRIN2BGRIN2C

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
WO-2018026763-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF APTINYX INC. (US) 2018-02-08 WO disclosed