SCHEMBL9657153

SCHEMBL9657153

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

nearest known ligand 0.50

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MEP1B Q16820 4/20 0.50
FOLH1 Q04609 4/20 0.47
MME P08473 2/20 0.46
ADAMTS4 O75173 1/20 0.45
MMP13 P45452 1/20 0.45
ANPEP P15144 1/20 0.44
ENPEP Q07075 1/20 0.44
ELANE P08246 1/20 0.44
FNTA P49354 2/20 0.42
FNTB P49356 2/20 0.42
PGGT1B P53609 1/20 0.42
GPR132 Q9UNW8 2/20 0.41

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
SCHEMBL9654344 1.00 MEP1B (0.50) MEP1BFOLH1MMEADAMTS4MMP13
SCHEMBL9655951 0.89 FOLH1 (0.44) MEP1BFOLH1MMEADAMTS4MMP13
SCHEMBL15387514 0.88 MME (0.55) MME
SCHEMBL15387515 0.88 MME (0.55) MME
SCHEMBL9633609 0.88 MME (0.55) MME
SCHEMBL10698881 0.84 FOLH1 (0.57) MEP1BFOLH1ANPEPENPEPFNTA
SCHEMBL3486738 0.81 MME (0.47) MME
SCHEMBL10700246 0.78 FOLH1 (0.43) MEP1BFOLH1MMEANPEPENPEP
SCHEMBL9657167 0.77 ANPEP (0.50) FOLH1ANPEPENPEPFNTAFNTB
SCHEMBL9633343 0.75 SMN1; SMN2 (0.53) MME

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