SCHEMBL9657167

SCHEMBL9657167

CC(CC(=O)C(CS)NC(=O)Cc1cccc(C(=O)O)c1)[C@@H](N)C(=O)O

nearest known ligand 0.50

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
ANPEP P15144 2/20 0.50
ENPEP Q07075 2/20 0.50
FNTA P49354 8/20 0.47
FNTB P49356 8/20 0.47
PGGT1B P53609 6/20 0.47
FOLH1 Q04609 6/20 0.44

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
SCHEMBL9655961 0.87 ANPEP (0.47) ANPEPENPEPFNTAFNTBPGGT1B
SCHEMBL10698881 0.81 FOLH1 (0.57) ANPEPENPEPFNTAFNTBPGGT1B
SCHEMBL9657153 0.77 MEP1B (0.50) ANPEPENPEPFNTAFNTBPGGT1B
SCHEMBL9654344 0.77 MEP1B (0.50) ANPEPENPEPFNTAFNTBPGGT1B
SCHEMBL9655951 0.74 FOLH1 (0.44) ANPEPENPEPFNTAFNTBPGGT1B
SCHEMBL9655967 0.73 ANPEP (0.43) ANPEPENPEPFNTAFNTBPGGT1B
SCHEMBL10700246 0.69 FOLH1 (0.43) ANPEPENPEPFNTAFNTBPGGT1B
SCHEMBL8551524 0.69 CNR1 (0.49) FOLH1
SCHEMBL1499949 0.68 CNR2 (0.57) FNTAFNTB
SCHEMBL3448804 0.68 CNR2 (0.57) FNTAFNTB

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-0268343-B1 ENZYMATIC PROCESS FOR 3-SUBSTITUTED CEPHALOSPORINS THE CHANCELLOR, MASTERS AND SCHOLARS OF THE UNIVERSITY OF OXFORD (GB) 1992-05-27 EP disclosed