SCHEMBL8309742

SCHEMBL8309742

COc1ccc(C(=O)N(c2ccc3c(c2)CN(C(=N)N)CC3)S(=O)(=O)c2ccc(OC3CCN(C=NC4CC4)CC3)cc2)cc1

nearest known ligand 0.53

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
F10 P00742 19/20 0.53
PRSS1 P07477 18/20 0.53
PRSS2 P07478 18/20 0.53
PRSS3 P35030 18/20 0.53
F2 P00734 8/20 0.49
PLG P00747 12/20 0.47
TMPRSS2 O15393 1/20 0.41

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
SCHEMBL8309138 0.90 F10 (0.52) F10PRSS1PRSS2PRSS3F2
SCHEMBL8311000 0.90 F10 (0.62) F10PRSS1PRSS2PRSS3F2
SCHEMBL8308946 0.88 F10 (0.60) F10PRSS1PRSS2PRSS3F2
SCHEMBL8311383 0.88 F10 (0.68) F10PRSS1PRSS2PRSS3F2
SCHEMBL8308032 0.86 F10 (0.49) F10PRSS1PRSS2PRSS3F2
SCHEMBL8308721 0.86 F10 (0.58) F10PRSS1PRSS2PRSS3F2
SCHEMBL8311460 0.84 F10 (0.50) F10PRSS1PRSS2PRSS3F2
SCHEMBL8312423 0.84 F10 (0.48) F10PRSS1PRSS2PRSS3F2
SCHEMBL8311411 0.83 F10 (0.47) F10PRSS1PRSS2PRSS3F2
SCHEMBL8309625 0.82 F10 (0.49) F10PRSS1PRSS2PRSS3F2

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
EP-0937723-A1 Novel sulfonamides, process for their preparation and medicaments containing them Roche Diagnostics GmbH (DE) 1999-08-25 EP disclosed