SCHEMBL5394696

SCHEMBL5394696

N=C(N)c1ccc(-c2ccc(-c3nc4ccc(C(=N)N)cc4[nH]3)cc2)nc1

nearest known ligand 0.78

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
PLAU P00749 6/20 0.68
PRSS1 P07477 2/20 0.68
PLG P00747 5/20 0.65
F2 P00734 4/20 0.59
F10 P00742 4/20 0.59
F7 P08709 3/20 0.59
CHEK2 O96017 1/20 0.58
PLAT P00750 1/20 0.55

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
Acetic Acid SCHEMBL6061722 0.93 PLAU (0.63) PLAUPRSS1PLGF2F10
SCHEMBL5402979 0.90 PLAU (0.54) PLAUPRSS1PLGF2F10
SCHEMBL30746755 0.89 PLAU (0.67) PLAUPRSS1PLGF2F10
SCHEMBL14519390 0.88 PLAU (0.86) PLAUPRSS1PLGF2F10
SCHEMBL5517426 0.87 PLAU (0.83) PLAUPRSS1PLGF2F10
SCHEMBL14355116 0.87 PLAU (0.83) PLAUPRSS1PLGF2F10
SCHEMBL24312880 0.85 PLAU (0.81) PLAUPRSS1PLGF2F10
SCHEMBL12348362 0.84 PLAU (0.79) PLAUPRSS1PLGF2F10
Acetic Acid SCHEMBL6514970 0.84 PLAU (0.51) PLAUPRSS1PLGF2F10
SCHEMBL14599555 0.83 PLAU (0.77) PLAUPRSS1PLGF2F10

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
JP-2007509176-A 2007-04-12 JP claimed
EP-1682518-A1 DICATIONIC TRIARYL ANALOGS AS ANTI-PROTOZOAN AGENTS UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2006-07-26 EP claimed
WO-2005040132-A1 DICATIONIC TRIARYL ANALOGS AS ANTI-PROTOZOAN AGENTS UNIVERSITY OF NORTH CAROLINA AT CHAPEL HILL (US) 2005-05-06 WO claimed