SCHEMBL1576692

SCHEMBL1576692

NS(=O)(=O)c1ccccc1C1=NOCCS1

nearest known ligand 0.36

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA1 P00915 4/20 0.36
CA2 P00918 4/20 0.36
CA6 P23280 3/20 0.36
CA9 Q16790 3/20 0.36
CA4 P22748 2/20 0.36
CA12 O43570 2/20 0.36
CA5A P35218 2/20 0.36
CA7 P43166 2/20 0.36
CA5B Q9Y2D0 2/20 0.36
CYP2C9 P11712 1/20 0.36
CA14 Q9ULX7 1/20 0.36
STAT3 P40763 1/20 0.36
F10 P00742 10/20 0.34
ALOX5AP P20292 4/20 0.34
FEN1 P39748 4/20 0.34
SCN9A Q15858 1/20 0.32

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
SCHEMBL1576847 0.79 CA1 (0.32) CA1CA2CA6CA9CA4
SCHEMBL1577258 0.78 CA1 (0.33) CA1CA2CA9CA4CA12
SCHEMBL11214939 0.77 ALDH1A1 (0.40) CA1CA2CA6CA9CA4
SCHEMBL1576746 0.75
SCHEMBL29469898 0.73 CA1 (0.38) CA1CA2CA6CA9CA4
SCHEMBL7901217 0.73 CA1 (0.38) CA1CA2CA6CA9CA4
SCHEMBL1576938 0.70 PLK1 (0.31)
SCHEMBL1080972 0.69 CA2 (0.61) CA1CA2CA6CA9CA4
SCHEMBL1577055 0.69 L3MBTL1 (0.32)
SCHEMBL8347239 0.67 CA2 (0.58) CA1CA2CA6CA9CA4

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2011039276-A1 OXATHIAZINYL(HET)ARYLSULFONYLUREAS, PROCESSES AND INTERMEDIATES FOR PREPARATION THEREOF AND USE THEREOF AS CROP PROTECTION AGENTS AND CROP GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2011-04-07 WO disclosed
WO-2011039276-A1 OXATHIAZINYL(HET)ARYLSULFONYLUREAS, PROCESSES AND INTERMEDIATES FOR PREPARATION THEREOF AND USE THEREOF AS CROP PROTECTION AGENTS AND CROP GROWTH REGULATORS BAYER CROPSCIENCE AG (DE) 2011-04-07 WO disclosed