SCHEMBL22081086

SCHEMBL22081086

NC(=O)[C@@H](O)C[C@@H](N)CO

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
OR51E2 Q9H255 1/20 0.36
SLC1A1 P43005 1/20 0.33
USP2 O75604 1/20 0.32
SLCO1B1 Q9Y6L6 1/20 0.32
ENPEP Q07075 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
SCHEMBL22081147 1.00 OR51E2 (0.36) OR51E2SLC1A1USP2SLCO1B1ENPEP
SCHEMBL22081084 1.00 OR51E2 (0.36) OR51E2SLC1A1USP2SLCO1B1ENPEP
SCHEMBL22081085 0.80 GABRR1 (0.32) ENPEP
SCHEMBL22081798 0.80 GABRR1 (0.32) ENPEP
SCHEMBL24355132 0.78 OR51E2 (0.35) OR51E2SLC1A1USP2SLCO1B1ENPEP
SCHEMBL5576947 0.78 CA1 (0.35) SLC1A1ENPEP
SCHEMBL10788013 0.77 LMNA (0.40) OR51E2SLC1A1
SCHEMBL1136114 0.75
SCHEMBL4107937 0.75
SCHEMBL294878 0.75

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
WO-2020115190-A1 NOVEL ANTIBACTERIAL 3\"-DERIVATIVES OF 4,6-DISUBSTITUTED 2,5-DIDEOXYSTREPTAMINE AMINOGLYCOSIDE ANTIBIOTICS AGILEBIOTICS B.V. (NL) 2020-06-11 WO disclosed