SCHEMBL8290804

SCHEMBL8290804

N=C(N)c1ccc(CNC(=O)CNC(=O)C(Cc2cccnc2)NS(=O)(=O)Cc2ccccc2)cc1

nearest known ligand 0.52

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ F2 P00734 15/20 0.52
▸ TMPRSS6 Q8IU80 4/20 0.52
▸ TMPRSS11D O60235 9/20 0.49
▸ F10 P00742 7/20 0.48
▸ PLG P00747 6/20 0.48
▸ KLKB1 P03952 1/20 0.48
▸ PROC P04070 1/20 0.48
▸ ADRA1B P35368 1/20 0.46
▸ PRSS1 P07477 1/20 0.46
▸ TMPRSS2 O15393 2/20 0.45

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
SCHEMBL8289954 0.92 F10 (0.54) F2TMPRSS6TMPRSS11DF10PLG
SCHEMBL12156653 0.91 F2 (0.61) F2TMPRSS6TMPRSS11DF10PLG
SCHEMBL8289952 0.90 F10 (0.52) F2TMPRSS6TMPRSS11DF10PLG
SCHEMBL8358388 0.87 F2 (0.59) F2TMPRSS6TMPRSS11DF10PLG
SCHEMBL8346530 0.85 F2 (0.57) F2TMPRSS6TMPRSS11DF10PLG
SCHEMBL14567283 0.84 F10 (0.58) F2TMPRSS6TMPRSS11DF10PLG
SCHEMBL8290836 0.84 F10 (0.58) F2TMPRSS6TMPRSS11DF10PLG
SCHEMBL8290745 0.84 F10 (0.58) F2TMPRSS6TMPRSS11DF10PLG
SCHEMBL8290806 0.84 F2 (0.47) F2TMPRSS6TMPRSS11DF10PLG
SCHEMBL8291001 0.84 F10 (0.56) F2TMPRSS6TMPRSS11DF10PLG

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005026198-A1 BASE-SUBSTITUTED BENZYLAMINE ANALOGS FOR USE AS COAGULATION FACTOR XA INHIBITORS, THE PRODUCTION AND USE THEREOF CURACYTE CHEMISTRY GMBH (DE) 2005-03-24 — — WO disclosed
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