SCHEMBL9500859

SCHEMBL9500859

CS(=O)(=O)c1ccc(C[C@@H](N)[C@H](O)C(=O)C2(C(=O)O)CC2N)cc1

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EPHX1 P07099 1/20 0.39
KDM1A O60341 1/20 0.36
LTA4H P09960 2/20 0.34
GRM4 Q14833 1/20 0.34
LAP3 P28838 3/20 0.34
ANPEP P15144 1/20 0.34
RNPEP Q9H4A4 1/20 0.34
DNPEP Q9ULA0 1/20 0.34
DPP4 P27487 3/20 0.34
DPP7 Q9UHL4 3/20 0.34
SMN1; SMN2 Q16637 1/20 0.33
CTSC P53634 2/20 0.32
ITGB1 P05556 1/20 0.32
ITGA4 P13612 1/20 0.32
PTGS2 P35354 1/20 0.32
AKR1C3 P42330 1/20 0.32
F2 P00734 1/20 0.31
GRIN2B Q13224 1/20 0.31

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
SCHEMBL9500623 0.90 EPHX1 (0.39) EPHX1KDM1ALTA4HGRM4LAP3
SCHEMBL9500554 0.88 EPHX1 (0.40) EPHX1KDM1ALTA4HGRM4LAP3
SCHEMBL9500909 0.88 EPHX1 (0.40) EPHX1KDM1ALTA4HGRM4LAP3
SCHEMBL9498640 0.88 EPHX1 (0.40) EPHX1KDM1ALTA4HGRM4LAP3
SCHEMBL9500871 0.87 EPHX1 (0.42) EPHX1KDM1ADPP4DPP7CTSC
SCHEMBL9500847 0.74 LAP3 (0.44) EPHX1LTA4HGRM4LAP3ANPEP
SCHEMBL9500894 0.73 LAP3 (0.42) EPHX1LTA4HGRM4LAP3ANPEP
SCHEMBL9498619 0.73 LAP3 (0.42) EPHX1LTA4HGRM4LAP3ANPEP
SCHEMBL9500612 0.73 LAP3 (0.42) EPHX1LTA4HGRM4LAP3ANPEP
SCHEMBL9500536 0.73 LAP3 (0.42) EPHX1LTA4HGRM4LAP3ANPEP

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