SCHEMBL8804152

SCHEMBL8804152

[CH2]C(C)(C)NS(=O)(=O)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
CA2 P00918 3/20 0.42
CA1 P00915 2/20 0.42
PTPN11 Q06124 1/20 0.36
EPHX1 P07099 1/20 0.34
F2 P00734 1/20 0.31
PRSS1 P07477 1/20 0.31
PRSS2 P07478 1/20 0.31
PRSS3 P35030 1/20 0.31
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
CA7 P43166 1/20 0.30
CA13 Q8N1Q1 1/20 0.30

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
SCHEMBL6123555 0.78 CA2 (0.46) CA2CA1PTPN11EPHX1MAPK1
SCHEMBL22004000 0.72 CA1 (0.40) CA2CA1PTPN11EPHX1
SCHEMBL228558 0.71 CA2 (0.50) CA2CA1PTPN11EPHX1MAPK1
SCHEMBL28936404 0.70 CA1 (0.39) CA2CA1PTPN11EPHX1F2
SCHEMBL21629339 0.69 CA2 (0.48) CA2CA1PTPN11EPHX1CA7
SCHEMBL21831901 0.69 CA2 (0.48) CA2CA1PTPN11EPHX1CA7
SCHEMBL20725006 0.69 CA2 (0.48) CA2CA1PTPN11EPHX1CA7
SCHEMBL28529581 0.69 CA2 (0.48) CA2CA1PTPN11EPHX1CA7
SCHEMBL17292686 0.69 CA2 (0.48) CA2CA1PTPN11EPHX1CA7
SCHEMBL20723413 0.69 CA2 (0.48) CA2CA1PTPN11EPHX1CA7

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
CN-1070173-C Benzoylguanidine derivatives as medicaments FUJISAWA PHARMACEUTICAL CO (JP) 2001-08-29 CN disclosed
CN-1158606-A Benzoylguanidine derivatives as medicaments FUJISAWA PHARMACEUTICAL CO (JP) 1997-09-03 CN disclosed
EP-0773927-A2 BENZOYLGUANIDINE DERIVATIVES AS MEDICAMENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1997-05-21 EP disclosed
WO-1996004241-A2 BENZOYLGUANIDINE DERIVATIVES AS MEDICAMENTS FUJISAWA PHARMACEUTICAL CO., LTD. (JP) 1996-02-15 WO disclosed