SCHEMBL14159676

SCHEMBL14159676

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

nearest known ligand 0.43

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ ENPEP Q07075 2/20 0.43
▸ SLC7A5 Q01650 1/20 0.39
▸ SLC1A1 P43005 4/20 0.37
▸ SLC1A3 P43003 4/20 0.36
▸ SLC1A2 P43004 4/20 0.36
▸ GABRR1 P24046 2/20 0.35
▸ FOLH1 Q04609 2/20 0.35
▸ NAALAD2 Q9Y3Q0 2/20 0.35
▸ LTA4H P09960 1/20 0.33

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
SCHEMBL23408741 0.85 SLC7A5 (0.45) SLC7A5SLC1A1SLC1A3SLC1A2
SCHEMBL17423638 0.77 SLC7A5 (0.40) SLC7A5SLC1A1SLC1A3SLC1A2
SCHEMBL2494012 0.74 TSHR (0.40) SLC7A5SLC1A1SLC1A3SLC1A2
SCHEMBL4534790 0.74 TSHR (0.40) SLC7A5SLC1A1SLC1A3SLC1A2
SCHEMBL2494007 0.74 TSHR (0.40) SLC7A5SLC1A1SLC1A3SLC1A2
SCHEMBL2812860 0.74 SLC7A5 (0.34) SLC7A5SLC1A1SLC1A3SLC1A2
SCHEMBL1537267 0.74 SLC7A5 (0.41) SLC7A5SLC1A1SLC1A3SLC1A2
SCHEMBL135879 0.74 SLC7A5 (0.41) SLC7A5SLC1A1SLC1A3SLC1A2
SCHEMBL14159744 0.73 ENPEP (0.33) ENPEPGABRR1
SCHEMBL28829110 0.73 SLC7A5 (0.31) 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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1204643-B1 FUNGICIDAL HETEROCYCLIC AROMATIC AMIDES AND THEIR COMPOSITIONS, METHODS OF USE AND PREPARATION DOW AGROSCIENCES LLC (US) 2008-06-04 — — EP disclosed
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