SCHEMBL5050477

SCHEMBL5050477

COC(=O)CC(=O)CC(N)C(=O)O

nearest known ligand 0.53

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC1A1 P43005 4/20 0.53
SLC7A5 Q01650 2/20 0.50
GRIK1 P39086 9/20 0.44
GRIK2 Q13002 5/20 0.44
GRM1 Q13255 1/20 0.42
GRM2 Q14416 1/20 0.42
GRIA4 P48058 3/20 0.41
GRIK3 Q13003 3/20 0.41
GRIK5 Q16478 3/20 0.41
SLC1A3 P43003 4/20 0.41
SLC1A2 P43004 4/20 0.41
GRIA2 P42262 2/20 0.40
GRIA1 P42261 1/20 0.40
GFPT1 Q06210 1/20 0.40
MGAM O43451 1/20 0.39
GAA P10253 1/20 0.39
SI P14410 1/20 0.39
MGAM2 Q2M2H8 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
SCHEMBL536243 0.85 SLC1A1 (0.58) SLC1A1SLC7A5GRIK1GRIK2GRM1
SCHEMBL2018995 0.85 SLC1A1 (0.58) SLC1A1SLC7A5GRIK1GRIK2GRM1
SCHEMBL151676 0.85 SLC1A1 (0.58) SLC1A1SLC7A5GRIK1GRIK2GRM1
Hydrochloric Acid SCHEMBL23851398 0.83 SLC1A1 (0.56) SLC1A1SLC7A5GRIK1GRIK2GRM1
Hydrochloric Acid SCHEMBL933300 0.83 SLC1A1 (0.56) SLC1A1SLC7A5GRIK1GRIK2GRM1
SCHEMBL2238405 0.83 SLC1A1 (0.56) SLC1A1SLC7A5GRIK1GRIK2GRM1
Hydrochloric Acid SCHEMBL6506409 0.83 SLC1A1 (0.56) SLC1A1SLC7A5GRIK1GRIK2GRM1
SCHEMBL14456726 0.82 MGAM (0.50) SLC1A1SLC7A5GRIK1GRIK2GRM1
Hydrochloric Acid SCHEMBL5623486 0.81 MGAM (0.48) SLC1A1SLC7A5GRIK1GRIK2GRM1
Hydrochloric Acid SCHEMBL5622539 0.81 MGAM (0.48) SLC1A1SLC7A5GRIK1GRIK2GRM1

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
US-9045507-B2 Coumarin-based amino acids for use in enzyme activity and substrate specificity assays UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2015-06-02 US disclosed
EP-1946102-A1 COUMARIN-BASED AMINO ACIDS FOR USE IN ENZYME ACTIVITY AND SUBSTRATE SPECIFICITY ASSAYS UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2008-07-23 EP disclosed
US-20070031892-A1 Novel coumarin-based amino acids for use in enzyme activity and substrate specificity assays USC 2007-02-08 US disclosed
WO-2007014326-A1 COUMARIN-BASED AMINO ACIDS FOR USE IN ENZYME ACTIVITY AND SUBSTRATE SPECIFICITY ASSAYS UNIVERSITY OF SOUTHERN CALIFORNIA (US) 2007-02-01 WO disclosed