SCHEMBL16972731

SCHEMBL16972731

CC(C)C[C@H](N)C(=O)OC(=O)C[C@H](N)C(=O)O

nearest known ligand 0.64

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.64
SLC1A3 P43003 6/20 0.52
SLC1A2 P43004 6/20 0.52
SLC1A1 P43005 7/20 0.44
GRIK1 P39086 8/20 0.43
GRIK2 Q13002 4/20 0.43
GRIA4 P48058 3/20 0.41
GRIK3 Q13003 3/20 0.41
GRIK5 Q16478 3/20 0.41
GRIA2 P42262 2/20 0.40
GRIA1 P42261 1/20 0.40
ANPEP P15144 1/20 0.38
RNPEP Q9H4A4 1/20 0.38
DNPEP Q9ULA0 1/20 0.38
GRM1 Q13255 1/20 0.37
GRM2 Q14416 1/20 0.37

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
SCHEMBL4867035 0.91 SLC7A5 (0.48) SLC7A5SLC1A3SLC1A2SLC1A1ANPEP
SCHEMBL21682803 0.88 SLC7A5 (0.47) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL10527497 0.87 SLC7A5 (0.45) SLC7A5SLC1A3SLC1A2SLC1A1ANPEP
SCHEMBL9701317 0.87 GRIK1 (0.45) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL17222477 0.87 GRIK1 (0.45) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL27990876 0.84 SLC7A5 (0.45) SLC7A5SLC1A3SLC1A2SLC1A1ANPEP
SCHEMBL5707690 0.83 SLC7A5 (0.48) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL3512082 0.83 SLC7A5 (0.55) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL6239265 0.81 GRIK1 (0.41) SLC7A5SLC1A3SLC1A2SLC1A1GRIK1
SCHEMBL15655614 0.81 SLC7A5 (0.50) SLC7A5SLC1A3SLC1A2SLC1A1ANPEP

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3102611-A1 HUMANIZED BETA-AMYLOID BINDING MOLECULES AND USES THEREOF Cangene Corporation (CA) 2016-12-14 EP disclosed
WO-2015113169-A1 HUMANIZED BETA-AMYLOID BINDING MOLECULES AND USES THEREOF CNJ HOLDINGS, INC. (CA) 2015-08-06 WO disclosed