SCHEMBL10698846

SCHEMBL10698846

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nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SLC1A3 P43003 8/20 0.52
SLC1A2 P43004 8/20 0.52
SLC1A1 P43005 8/20 0.52
SLC7A5 Q01650 2/20 0.42
ACHE P22303 1/20 0.36
USP2 O75604 1/20 0.34
SLCO1B1 Q9Y6L6 1/20 0.34
GLO1 Q04760 1/20 0.32
GRIK1 P39086 1/20 0.32
GRIK2 Q13002 1/20 0.32

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
SCHEMBL28672094 0.82 SLC1A3 (0.52) SLC1A3SLC1A2SLC1A1SLC7A5ACHE
SCHEMBL9235975 0.79 SLC1A3 (0.41) SLC1A3SLC1A2SLC1A1SLC7A5ACHE
SCHEMBL10373135 0.76 SLC1A3 (0.34) SLC1A3SLC1A2SLC1A1
SCHEMBL7636697 0.74 SLC1A3 (0.33) SLC1A3SLC1A2SLC1A1SLC7A5
SCHEMBL2231192 0.74 TDP1 (0.37) SLC1A3SLC1A2SLC1A1
SCHEMBL7279279 0.73 CYP2C19 (0.43) SLC1A3SLC1A2SLC1A1
Isoleucine SCHEMBL9117832 0.71 SLC1A3 (0.45) SLC1A3SLC1A2SLC1A1SLC7A5
SCHEMBL755924 0.70 SLC7A5 (0.50) SLC1A3SLC1A2SLC1A1SLC7A5USP2
SCHEMBL2424284 0.70
SCHEMBL1168875 0.70 SLC7A5 (0.50) SLC1A3SLC1A2SLC1A1SLC7A5USP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0260778-A1 Enzymatic process for B-Lactams THE CHANCELLOR, MASTERS AND SCHOLARS OF THE UNIVERSITY OF OXFORD (GB) 1988-03-23 EP disclosed