SCHEMBL9500612

SCHEMBL9500612

CS(=O)(=O)c1ccc(C[C@@H](N)[C@H](O)C(=O)NC2(C(=O)O)CCC2)cc1

nearest known ligand 0.42

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 2/20 0.42
ANPEP P15144 1/20 0.42
RNPEP Q9H4A4 1/20 0.42
DNPEP Q9ULA0 1/20 0.42
EPHX1 P07099 1/20 0.38
CYP1A2 P05177 1/20 0.38
LTA4H P09960 1/20 0.35
ITGB1 P05556 3/20 0.34
ITGA4 P13612 3/20 0.34
PTGS2 P35354 1/20 0.33
GRM4 Q14833 1/20 0.33
CTSC P53634 1/20 0.33
ACE P12821 1/20 0.33
LMNA P02545 1/20 0.33
TSHR P16473 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33
METAP2 P50579 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
SCHEMBL9498619 0.98 LAP3 (0.42) LAP3ANPEPRNPEPDNPEPEPHX1
SCHEMBL9500536 0.98 LAP3 (0.42) LAP3ANPEPRNPEPDNPEPEPHX1
SCHEMBL9500894 0.98 LAP3 (0.42) LAP3ANPEPRNPEPDNPEPEPHX1
SCHEMBL9500855 0.97 LAP3 (0.41) LAP3ANPEPRNPEPDNPEPEPHX1
SCHEMBL9500847 0.95 LAP3 (0.44) LAP3ANPEPRNPEPDNPEPEPHX1
SCHEMBL9498914 0.82 LAP3 (0.54) LAP3ANPEPRNPEPDNPEPLTA4H
Hydrochloric Acid SCHEMBL9500443 0.81 HTT (0.38) LAP3ANPEPRNPEPDNPEPEPHX1
SCHEMBL9502271 0.77 ECE1 (0.38) ITGB1ITGA4ACE
SCHEMBL9499477 0.76 CYP3A4 (0.46) CYP1A2TSHR
SCHEMBL9500568 0.74 LAP3 (0.43) LAP3ANPEPRNPEPDNPEPEPHX1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0333000-B1 PEPTIDES WITH INHIBITORY ACTIVITY OF ENZYMATIC SYSTEMS, PROCESS FOR THEIR PREPARATION AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM ZAMBON GROUP S.p.A. (IT) 1993-05-19 EP disclosed
US-5145872-A PEPTIDES WITH PHARMACEUTICAL ACTIVITY ZAMBON GROUP, S.P.A. (IT) 1992-09-08 US disclosed
EP-0333000-A2 Peptides with inhibitory activity of enzymatic systems, process for their preparation and pharmaceutical compositions containing them ZAMBON GROUP S.p.A. (IT) 1989-09-20 EP disclosed