SCHEMBL11117720

SCHEMBL11117720

NS(=O)(=O)c1ccc(Cl)c(O)c1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 12/20 0.59
CA1 P00915 11/20 0.59
CA9 Q16790 9/20 0.59
CA12 O43570 6/20 0.59
CA4 P22748 2/20 0.59
CA6 P23280 2/20 0.59
CA5A P35218 2/20 0.59
CA7 P43166 2/20 0.59
CA14 Q9ULX7 2/20 0.59
CA5B Q9Y2D0 2/20 0.59
VCAM1 P19320 1/20 0.56
CA3 P07451 1/20 0.52
CA13 Q8N1Q1 1/20 0.52
PTGS1 P23219 1/20 0.51
PTGS2 P35354 1/20 0.51
MAOA P21397 1/20 0.49
MAOB P27338 1/20 0.49
KDM4E B2RXH2 1/20 0.48
MEN1 O00255 1/20 0.48
GAA P10253 1/20 0.48

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
SCHEMBL5153928 0.84 GAA (0.52) CA2CA1CA9CA12CA4
SCHEMBL10422850 0.84 ALDH1A1 (0.55) CA2CA1CA9CA12CA4
SCHEMBL21550448 0.83 ALDH1A1 (0.48) CA2CA1CA9CA12CA4
SCHEMBL1803937 0.83 PTGS1 (0.66) CA2CA1CA9CA12CA4
SCHEMBL793608 0.82 CA2 (0.69) CA2CA1CA9CA12CA4
SCHEMBL5520735 0.79 CA2 (0.68) CA2CA1CA9CA12CA4
SCHEMBL1186046 0.78 CA2 (0.70) CA2CA1CA9CA12CA4
Clofenamide SCHEMBL310408 0.78 CA1 (0.59) CA2CA1CA9CA12CA4
SCHEMBL5805029 0.78 CA2 (0.61) CA2CA1CA9CA12CA4
Clofenamide SCHEMBL30748198 0.78 CA1 (0.59) CA2CA1CA9CA12CA4

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-0129478-A2 2-Sulfamoylbenzo (b) thiophene derivatives, their preparation and pharmaceutical composition for the treatment of elevated intraocular pressure MERCK & CO. INC. (US) 1984-12-27 EP disclosed