SCHEMBL19852943

SCHEMBL19852943

C[C@@H](O)[C@@H](C(N)=O)N1CCC2(CCCN2C(=O)C(C)(N)CCC(N)=O)C1=O

nearest known ligand 0.53

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
GRIN2B Q13224 1/20 0.53
GRIN2C Q14957 1/20 0.53

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
SCHEMBL19852942 0.85 GRIN2B (0.38) GRIN2BGRIN2C
SCHEMBL19852940 0.85 GRIN2B (0.38) GRIN2BGRIN2C
SCHEMBL19852944 0.84 GRIN2B (0.38) GRIN2BGRIN2C
SCHEMBL24339036 0.80 GRIN2B (0.50) GRIN2BGRIN2C
SCHEMBL19852813 0.79 GRIN2B (0.58) GRIN2BGRIN2C
SCHEMBL19852952 0.79 GRIN2B (0.55) GRIN2BGRIN2C
SCHEMBL24339072 0.78 GRIN2B (0.57) GRIN2BGRIN2C
SCHEMBL24339067 0.78 GRIN2B (0.84) GRIN2BGRIN2C
SCHEMBL24338655 0.78 GRIN2B (0.53) GRIN2BGRIN2C
SCHEMBL24338580 0.76 GRIN2B (0.55) 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-2018026779-A1 SPIRO-LACTAM NMDA RECEPTOR MODULATORS AND USES THEREOF APTINYX INC. (US) 2018-02-08 WO disclosed