SCHEMBL9500847

SCHEMBL9500847

CS(=O)(=O)c1ccc(C[C@@H](N)[C@H](O)C(=O)NC2(C(=O)O)CC2)cc1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LAP3 P28838 3/20 0.44
ANPEP P15144 1/20 0.44
RNPEP Q9H4A4 1/20 0.44
DNPEP Q9ULA0 1/20 0.44
LTA4H P09960 2/20 0.37
EPHX1 P07099 1/20 0.37
GRM4 Q14833 1/20 0.34
ITGB1 P05556 1/20 0.34
ITGA4 P13612 1/20 0.34
CTSC P53634 1/20 0.34
LMNA P02545 2/20 0.34
CYP1A2 P05177 1/20 0.34
TSHR P16473 1/20 0.34
ACE P12821 1/20 0.34
METAP2 P50579 1/20 0.33
MEN1 O00255 1/20 0.33
CYP3A4 P08684 1/20 0.33
KMT2A Q03164 1/20 0.33
F2 P00734 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
SCHEMBL9500894 0.95 LAP3 (0.42) LAP3ANPEPRNPEPDNPEPLTA4H
SCHEMBL9500536 0.95 LAP3 (0.42) LAP3ANPEPRNPEPDNPEPLTA4H
SCHEMBL9500612 0.95 LAP3 (0.42) LAP3ANPEPRNPEPDNPEPLTA4H
SCHEMBL9498619 0.95 LAP3 (0.42) LAP3ANPEPRNPEPDNPEPLTA4H
SCHEMBL9500855 0.94 LAP3 (0.41) LAP3ANPEPRNPEPDNPEPLTA4H
Hydrochloric Acid SCHEMBL9500443 0.81 HTT (0.38) LAP3ANPEPRNPEPDNPEPLTA4H
SCHEMBL9498914 0.79 LAP3 (0.54) LAP3ANPEPRNPEPDNPEPLTA4H
SCHEMBL9500568 0.76 LAP3 (0.43) LAP3ANPEPRNPEPDNPEPLTA4H
SCHEMBL9502271 0.75 ECE1 (0.38) ITGB1ITGA4ACE
SCHEMBL9500859 0.74 EPHX1 (0.39) LAP3ANPEPRNPEPDNPEPLTA4H

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 2 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