SCHEMBL7360668

SCHEMBL7360668

N=C(N)c1ccc(Cn2c(-c3ccccc3)c(-c3ccccc3)n(Cc3ccc4ccc(C(=N)N)cc4c3)c2=O)cc1

nearest known ligand 0.54

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
F2 P00734 11/20 0.54
F10 P00742 10/20 0.54
PRSS1 P07477 7/20 0.54
PLAU P00749 5/20 0.49
PLG P00747 2/20 0.44
KLKB1 P03952 1/20 0.44
KLK1 P06870 1/20 0.44
F7 P08709 5/20 0.43
F3 P13726 4/20 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
SCHEMBL7366139 0.98 F10 (0.53) F2F10PRSS1PLAUPLG
SCHEMBL8909375 0.93 F10 (0.53) F2F10PRSS1PLAUPLG
SCHEMBL7358748 0.89 WDR5 (0.50) F2F10PRSS1PLAUKLKB1
SCHEMBL8908041 0.88 F10 (0.53) F2F10PRSS1
SCHEMBL7364511 0.83 F10 (0.57) F2F10PRSS1
SCHEMBL8483349 0.80 F2 (0.43) F2F10PRSS1PLAUPLG
SCHEMBL8443655 0.79 F10 (0.43) F2F10PRSS1PLAUPLG
SCHEMBL7360640 0.77 PLAU (0.56) F2F10PRSS1PLAUPLG
SCHEMBL8438856 0.76 F10 (0.49) F2F10PRSS1
SCHEMBL8908116 0.76 F10 (0.49) F2F10PRSS1PLAUPLG

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0848708-A1 N,N-DI(ARYLMETHYL)CYCLIC UREA DERIVATIVES AS ANTI-COAGULANTS BERLEX LABORATORIES, INC. (US) 1998-06-24 EP claimed
US-5612363-A FACTOR XA INHIBITORS BERLEX LABORATORIES, INC. (US) 1997-03-18 US claimed
WO-1996038421-A1 N,N-DI(ARYLMETHYL)CYCLIC UREA DERIVATIVES AS ANTI-COAGULANTS BERLEX LABORATORIES, INC. (US) 1996-12-05 WO claimed
US-5612363-A FACTOR XA INHIBITORS BERLEX LABORATORIES, INC. (US) 1997-03-18 US disclosed