SCHEMBL9303301

SCHEMBL9303301

N=C(N)Nc1cccc(C(=O)Nc2ccc3c(C(=N)N)cccc3c2)c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PTGES O14684 1/20 0.49
PLAU P00749 5/20 0.46
F2 P00734 4/20 0.46
PRSS1 P07477 4/20 0.46
PLG P00747 3/20 0.46
KLKB1 P03952 3/20 0.46
PLAT P00750 2/20 0.46
KLK1 P06870 1/20 0.46
F10 P00742 1/20 0.46
SIRT2 Q8IXJ6 1/20 0.45
NPC1 O15118 4/20 0.45
RAB9A P51151 4/20 0.45
KMT2A Q03164 4/20 0.45
MEN1 O00255 3/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
KDM4E B2RXH2 1/20 0.45
CASP3 P42574 1/20 0.45
SENP7 Q9BQF6 1/20 0.45
SENP6 Q9GZR1 1/20 0.45
PLK4 O00444 1/20 0.44

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
SCHEMBL9303394 0.91 PLAU (0.47) PLAUF2PRSS1PLGKLKB1
SCHEMBL9304321 0.91 PLAU (0.50) PTGESPLAUF2PRSS1PLG
SCHEMBL9302840 0.89 PTGES (0.51) PTGESPLAUF2PRSS1PLG
SCHEMBL9303292 0.83 RXFP1 (0.52) PTGESPLAUF2PLGPLAT
SCHEMBL9303115 0.82 PLAU (0.53) PLAUF2PRSS1PLGKLKB1
SCHEMBL9303308 0.81 PTGES (0.56) PTGESSIRT2NPC1RAB9AKMT2A
SCHEMBL9303041 0.81 PLAU (0.61) PLAUF2PRSS1PLGKLKB1
SCHEMBL9305779 0.81 PLAU (0.71) PLAUF2PRSS1PLGKLKB1
SCHEMBL9303936 0.81 PTGES (0.52) PTGESPLAUF2PRSS1PLG
SCHEMBL9303751 0.80 ITGB3 (0.62) PLAUF2PRSS1PLGKLKB1

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