SCHEMBL7359265

SCHEMBL7359265

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

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 6/20 0.54
SLC7A5 Q01650 2/20 0.52
SLC1A3 P43003 5/20 0.47
SLC1A2 P43004 5/20 0.47
GRIK1 P39086 8/20 0.42
GRIK2 Q13002 4/20 0.42
GRIA4 P48058 3/20 0.42
GRIK3 Q13003 3/20 0.42
GRIK5 Q16478 3/20 0.42
GRIA2 P42262 2/20 0.42
GRIA1 P42261 1/20 0.42
GRM1 Q13255 1/20 0.39
GRM2 Q14416 1/20 0.39
BHMT Q93088 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
SCHEMBL9449386 1.00 SLC1A1 (0.54) SLC1A1SLC7A5SLC1A3SLC1A2GRIK1
SCHEMBL2018995 0.86 SLC1A1 (0.58) SLC1A1SLC7A5SLC1A3SLC1A2GRIK1
SCHEMBL151676 0.86 SLC1A1 (0.58) SLC1A1SLC7A5SLC1A3SLC1A2GRIK1
SCHEMBL536243 0.86 SLC1A1 (0.58) SLC1A1SLC7A5SLC1A3SLC1A2GRIK1
Hydrochloric Acid SCHEMBL23851398 0.84 SLC1A1 (0.56) SLC1A1SLC7A5SLC1A3SLC1A2GRIK1
SCHEMBL2238405 0.84 SLC1A1 (0.56) SLC1A1SLC7A5SLC1A3SLC1A2GRIK1
Hydrochloric Acid SCHEMBL933300 0.84 SLC1A1 (0.56) SLC1A1SLC7A5SLC1A3SLC1A2GRIK1
Hydrochloric Acid SCHEMBL6506409 0.84 SLC1A1 (0.56) SLC1A1SLC7A5SLC1A3SLC1A2GRIK1
Hydrochloric Acid SCHEMBL25212271 0.82 SLC1A1 (0.55) SLC1A1SLC7A5SLC1A3SLC1A2GRIK1
SCHEMBL5707302 0.81 SLC7A5 (0.44) SLC1A1SLC7A5SLC1A3SLC1A2GRIK1

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
CN-1063430-C Ethanolamine derivatives FUJISAWA PHARMACEUTICAL CO (JP) 2001-03-21 CN disclosed
EP-0801654-A1 N-SUBSTITUTED GLYCINE DERIVATIVES AS INHIBITORS OF FACTOR Xa CORVAS INTERNATIONAL, INC. (US) 1997-10-22 EP disclosed
WO-1996019493-A1 N-SUBSTITUTED GLYCINE DERIVATIVES AS INHIBITORS OF FACTOR Xa CORVAS INTERNATIONAL, INC. (US) 1996-06-27 WO disclosed
CN-1084846-A Ethanolamine derivant FUJISAWA PHARMACEUTICAL CO (JP) 1994-04-06 CN disclosed