SCHEMBL1576847

SCHEMBL1576847

NS(=O)(=O)c1ncccc1C1=NOCCS1

nearest known ligand 0.32

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 11/20 0.32
CA2 P00918 11/20 0.32
CA9 Q16790 6/20 0.32
CA12 O43570 5/20 0.32
CA3 P07451 1/20 0.32
CA4 P22748 1/20 0.32
CA6 P23280 1/20 0.32
CA5A P35218 1/20 0.32
CA7 P43166 1/20 0.32
CA13 Q8N1Q1 1/20 0.32
CA14 Q9ULX7 1/20 0.32
CA5B Q9Y2D0 1/20 0.32
MAPK1 P28482 1/20 0.31
KCNH2 Q12809 1/20 0.31
S100A4 P26447 1/20 0.31
TDP2 O95551 1/20 0.30
NSD2 O96028 1/20 0.30
ABL1 P00519 1/20 0.30
PLCG1 P19174 1/20 0.30
CES1 P23141 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
SCHEMBL1576998 0.81
SCHEMBL1576692 0.79 CA1 (0.36) CA1CA2CA9CA12CA4
SCHEMBL1203236 0.76 CA1 (0.33) CA1CA2CA9CA12MAPK1
SCHEMBL3776593 0.75 CA1 (0.33) CA1CA2CA9CA12MAPK1
SCHEMBL1577258 0.75 CA1 (0.33) CA1CA2CA9CA12CA4
SCHEMBL1576931 0.73 ALOX5AP (0.35) CA1CA2CA9CA12CA3
SCHEMBL10750298 0.67 NPC1 (0.39) CA1CA2MEN1KMT2ATDP1
SCHEMBL1576746 0.67
SCHEMBL1576938 0.67 PLK1 (0.31)
SCHEMBL8724464 0.66 KCNH2 (0.49) CA1CA2CA9CA12MAPK1

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