SCHEMBL9303515

SCHEMBL9303515

N=C(N)Nc1cccc(C(=O)Nc2c(C(=N)N)ccc3ccccc23)c1

nearest known ligand 0.48

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.48
PLAU P00749 4/20 0.48
F2 P00734 3/20 0.48
PRSS1 P07477 3/20 0.48
PLG P00747 2/20 0.48
PLAT P00750 2/20 0.48
KLKB1 P03952 2/20 0.48
KLK1 P06870 1/20 0.48
KCNJ11 Q14654 9/20 0.47
MEN1 O00255 2/20 0.47
NPC1 O15118 2/20 0.47
RAB9A P51151 2/20 0.47
KMT2A Q03164 2/20 0.47
ABCC9 O60706 4/20 0.47
ABCC8 Q09428 4/20 0.47
KCNJ8 Q15842 4/20 0.47
F10 P00742 1/20 0.43

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
SCHEMBL9303908 0.86 PLG (0.48) PLAUF2PRSS1PLGPLAT
SCHEMBL9302840 0.83 PTGES (0.51) PTGESPLAUF2PRSS1PLG
SCHEMBL9304321 0.83 PLAU (0.50) PTGESPLAUF2PRSS1PLG
SCHEMBL9302845 0.82 PTGES (0.52) PTGESPLAUF2PRSS1PLG
SCHEMBL9302930 0.81 PTGES (0.51) PTGESPLAUF2PRSS1PLG
SCHEMBL9304320 0.81 PLAU (0.50) PTGESPLAUF2PRSS1PLG
SCHEMBL9303301 0.80 PTGES (0.49) PTGESPLAUF2PRSS1PLG
SCHEMBL9304048 0.79 SIRT2 (0.55) PTGESPLAUF2PRSS1PLG
SCHEMBL9304163 0.79 PTGES (0.54) PTGESPLAUF2PRSS1PLG
SCHEMBL9303308 0.78 PTGES (0.56) PTGESMEN1NPC1RAB9AKMT2A

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
US-5352704-A Antiviral agents BANYU PHARMACEUTICAL CO., LTD. (JP) 1994-10-04 US disclosed
EP-0434432-B1 Guanidinobenzene derivatives BANYU PHARMA CO LTD (JP) 1994-05-04 EP disclosed
EP-0434432-A1 Guanidinobenzene derivatives BANYU PHARMACEUTICAL CO., LTD. (JP) 1991-06-26 EP disclosed