SCHEMBL17100558

SCHEMBL17100558

C[C@H](N)C(=O)N(Cl)[C@@H](C)C(=O)O

nearest known ligand 0.37

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
SLC7A5 Q01650 2/20 0.37
TP53 P04637 1/20 0.32
LTA4H P09960 1/20 0.31
SLC1A3 P43003 1/20 0.30
SLC1A2 P43004 1/20 0.30
SLC1A1 P43005 1/20 0.30

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
SCHEMBL5478337 0.76 SLC7A5 (0.40) SLC7A5TP53LTA4HSLC1A3SLC1A2
SCHEMBL1852419 0.74 SLC7A5 (0.39) SLC7A5TP53LTA4HSLC1A3SLC1A2
SCHEMBL15390916 0.74 SLC7A5 (0.39) SLC7A5TP53LTA4HSLC1A3SLC1A2
SCHEMBL28177758 0.74 SLC7A5 (0.34) SLC7A5
SCHEMBL17100550 0.74
SCHEMBL17100552 0.74
SCHEMBL5313814 0.73 TP53 (0.36) SLC7A5TP53
SCHEMBL27689847 0.73 SLC7A5 (0.37) SLC7A5TP53LTA4HSLC1A3SLC1A2
SCHEMBL28762244 0.73 SLC7A5 (0.37) SLC7A5TP53LTA4HSLC1A3SLC1A2
SCHEMBL30636770 0.72 SLC7A5 (0.33) SLC7A5

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-3119799-A1 ANTIMICROBIAL COMPOUNDS Biomérieux (FR) 2017-01-25 EP disclosed
WO-2015140481-A1 ANTIMICROBIAL COMPOUNDS bioMérieux (FR) 2015-09-24 WO disclosed