SCHEMBL9303908

SCHEMBL9303908

N=C(N)Nc1ccc(C(=O)Nc2c(C(=N)N)ccc3ccccc23)cc1

nearest known ligand 0.50

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
PLG P00747 8/20 0.48
PLAU P00749 6/20 0.48
PLAT P00750 5/20 0.48
KLK1 P06870 4/20 0.48
F2 P00734 4/20 0.48
KLKB1 P03952 3/20 0.48
PRSS1 P07477 3/20 0.48
KCNJ11 Q14654 8/20 0.47
KLK6 Q92876 2/20 0.47
ABCC9 O60706 1/20 0.46
ABCC8 Q09428 1/20 0.46
KCNJ8 Q15842 1/20 0.46
F10 P00742 2/20 0.45
NQO2 P16083 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
SCHEMBL9303515 0.86 PTGES (0.48) PLGPLAUPLATKLK1F2
SCHEMBL9303759 0.81 PLAU (0.50) PLGPLAUPLATKLK1F2
SCHEMBL9303507 0.81 KDM4E (0.47) PLGKLK1KCNJ11KLK6
SCHEMBL9303113 0.81 CD40 (0.51) PLGPLAUPLATKLK1F2
SCHEMBL9302652 0.80 PLAU (0.48) PLGPLAUPLATKLK1F2
SCHEMBL9303115 0.80 PLAU (0.53) PLGPLAUPLATKLK1F2
SCHEMBL9302612 0.78 PLAU (0.55) PLGPLAUPLATKLK1F2
SCHEMBL9303615 0.77 PDCD1 (0.55) PLGPLAUPLATKLK1F2
SCHEMBL9302624 0.76 PLAU (0.53) PLGPLAUPLATKLK1F2
SCHEMBL9303394 0.76 PLAU (0.47) PLGPLAUPLATKLK1F2

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