SCHEMBL9303028

SCHEMBL9303028

N=C(N)Nc1ccc(C(=O)Nc2cccc3ccc(C(=N)N)cc23)cc1

nearest known ligand 0.63

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
PLAU P00749 15/20 0.63
PLG P00747 11/20 0.54
PRSS1 P07477 10/20 0.54
PLAT P00750 10/20 0.54
F2 P00734 9/20 0.54
KLK1 P06870 7/20 0.54
KLKB1 P03952 5/20 0.54
TRPV1 Q8NER1 1/20 0.53
NPC1 O15118 1/20 0.50
CYP1A2 P05177 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2D6 P10635 1/20 0.50
CYP2C9 P11712 1/20 0.50
CYP2C19 P33261 1/20 0.50
RAB9A P51151 1/20 0.50

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
SCHEMBL9302818 0.91 FGF1 (0.54) PLAUPLGPRSS1PLATF2
SCHEMBL9303249 0.90 PLAU (0.60) PLAUPLGPRSS1PLATF2
SCHEMBL9303274 0.84 PLAU (0.62) PLAUPLGPRSS1PLATF2
SCHEMBL7335597 0.82 PLAU (0.74) PLAUPLGPRSS1PLATF2
SCHEMBL9305495 0.81 PLAU (0.54) PLAUPLGPRSS1PLATF2
SCHEMBL9302624 0.81 PLAU (0.53) PLAUPLGPRSS1PLATF2
SCHEMBL7335327 0.81 PLAU (0.72) PLAUPLGPRSS1PLATF2
SCHEMBL9303405 0.81 NPC1 (0.48) PLAUPLGPLATF2KLK1
SCHEMBL9303344 0.80 PLAU (0.74) PLAUPLGPRSS1PLATF2
SCHEMBL28742391 0.80 PLAU (0.75) PLAUPLGPRSS1PLATF2

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