SCHEMBL9817877

SCHEMBL9817877

NS(=O)(=O)c1cc2ccoc2c(Cl)c1Cl

nearest known ligand 0.47

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CA1 P00915 17/20 0.47
CA2 P00918 17/20 0.47
CA4 P22748 3/20 0.47
CA12 O43570 10/20 0.42
CA9 Q16790 10/20 0.42
CA6 P23280 2/20 0.42
CA5A P35218 2/20 0.42
CA7 P43166 2/20 0.42
CA14 Q9ULX7 2/20 0.42
CA5B Q9Y2D0 2/20 0.42
LMNA P02545 1/20 0.42
CYP2C9 P11712 1/20 0.42
CA13 Q8N1Q1 1/20 0.42
ACLY P53396 1/20 0.36
CA3 P07451 1/20 0.35
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.34

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
SCHEMBL1037129 0.70 CA2 (0.50) CA1CA2CA4CA12CA9
SCHEMBL10867332 0.69 CA1 (0.42) CA1CA2CA4CA12CA9
SCHEMBL31525869 0.69 S1PR1 (0.42) CA1CA2CA12CA9ACLY
SCHEMBL21046778 0.68 ACLY (0.50) CA1CA2CA12CA9ACLY
Hydrochloric Acid SCHEMBL28293567 0.66 ACLY (0.48) CA1CA2CA12CA9ACLY
SCHEMBL5806005 0.63 CA2 (0.34) CA1CA2CA4CA12CA9
SCHEMBL20858621 0.62 CYP2A6 (0.38) TDP1
SCHEMBL6038911 0.62 CA1 (0.48) CA1CA2CA4CA12CA9
SCHEMBL18876021 0.62 TRPA1 (0.32) ACLY
SCHEMBL29120024 0.62 TET2 (0.40) CA1CA2CA4CA12CA9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0173899-B1 2,3-DIHYDROBENZOFURAN-5-SULFONAMIDE DERIVATIVES SHIONOGI & CO., LTD. (JP) 1991-12-18 EP disclosed
US-4659709-A LESS ADVERSE SIDE-EFFECTS SHIONOGI & CO. (JP) 1987-04-21 US disclosed
EP-0173899-A2 2,3-Dihydrobenzofuran-5-sulfonamide derivatives SHIONOGI & CO., LTD. (JP) 1986-03-12 EP disclosed