SCHEMBL17199753

SCHEMBL17199753

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

nearest known ligand 0.50

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 1/20 0.50
GRIK1 P39086 11/20 0.48
GRIK2 Q13002 7/20 0.48
SLC1A3 P43003 4/20 0.45
SLC1A2 P43004 4/20 0.45
SLC1A1 P43005 4/20 0.45
GRIA4 P48058 3/20 0.44
GRIK3 Q13003 3/20 0.44
GRIK5 Q16478 3/20 0.44
GRIA2 P42262 2/20 0.44
GRIA1 P42261 1/20 0.44
MMP1 P03956 1/20 0.42
MMP2 P08253 1/20 0.42
MMP3 P08254 1/20 0.42
MMP9 P14780 1/20 0.42
MMP13 P45452 1/20 0.42
GRM1 Q13255 1/20 0.42
GRM2 Q14416 1/20 0.42

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
SCHEMBL23120327 0.88 MMP1 (0.40) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
SCHEMBL21631777 0.86 MMP1 (0.39) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
SCHEMBL2200757 0.85 SLC7A5 (0.52) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
SCHEMBL14043512 0.85 SLC7A5 (0.52) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
SCHEMBL19107047 0.85 SLC7A5 (0.44) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
SCHEMBL9268142 0.78 MMP1 (0.45) MMP1MMP2MMP3MMP9MMP13
SCHEMBL29216380 0.77 GRIK1 (0.45) SLC7A5GRIK1GRIK2SLC1A3SLC1A2
SCHEMBL1938929 0.76 GABRR1 (0.39) SLC7A5SLC1A3SLC1A2SLC1A1MMP1
SCHEMBL13624500 0.76 MMP1 (0.38) SLC7A5MMP1MMP2MMP3MMP9
SCHEMBL151676 0.76 SLC1A1 (0.58) SLC7A5GRIK1GRIK2SLC1A3SLC1A2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2937087-B1 COMPOSITION AND FOOD OR DRINK SENTAN PHARMA INC (JP) 2021-02-24 EP disclosed
US-20190254984-A1 COMPOSITION AND FOOD OR DRINK ADVANCED MEDICAL FRONTIER CO., LTD. (JP) 2019-08-22 US disclosed
EP-3170512-A1 PHARMACEUTICAL COMPOSITION Sentan Pharma Inc. (JP) 2017-05-24 EP disclosed
US-20150342898-A1 COMPOSITION AND FOOD OR DRINK ADVANCED MEDICAL FRONTIER CO., LTD. (JP) 2015-12-03 US disclosed
EP-2937087-A1 COMPOSITION AND FOOD OR DRINK Advanced Medical Frontier Co., Ltd. (JP) 2015-10-28 EP disclosed