SCHEMBL9665995

SCHEMBL9665995

N=C(N)c1cccc(CC(NS(=O)(=O)c2ccc3ccccc3c2)C(=O)O)c1

nearest known ligand 0.74

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PLG P00747 12/20 0.74
F10 P00742 6/20 0.73
PLAU P00749 4/20 0.73
ST14 Q9Y5Y6 3/20 0.72
HPN P05981 3/20 0.72
HGFAC Q04756 2/20 0.72
F2 P00734 1/20 0.70
F12 P00748 2/20 0.70
KLKB1 P03952 2/20 0.70
PROC P04070 2/20 0.70

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
SCHEMBL8954699 1.00 PLG (0.74) PLGF10PLAUST14HPN
SCHEMBL8954940 0.91 PLG (0.65) PLGF10PLAUST14HPN
SCHEMBL9710389 0.89 F2 (0.70) PLGF10PLAUST14HPN
SCHEMBL8954840 0.89 PLG (0.65) PLGF10PLAUST14HPN
SCHEMBL9664068 0.87 F10 (0.71) PLGF10PLAUST14HPN
SCHEMBL8954939 0.86 PLG (0.63) PLGF10PLAUST14HPN
SCHEMBL8954805 0.86 PLG (0.66) PLGF10PLAUHPNF12
SCHEMBL3310154 0.85 MMP2 (0.71) F2
SCHEMBL31086814 0.85 MMP2 (0.71) F2
SCHEMBL5189194 0.85 MMP2 (0.71) F2

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-0511347-A1 META-SUBSTITUTED PHENYL ALANINE DERIVATIVES Pentapharm A.G. (CH) 1992-11-04 EP disclosed
WO-1992008709-A1 META-SUBSTITUTED PHENYL ALANINE DERIVATIVES PENTAPHARM AG (CH) 1992-05-29 WO disclosed