SCHEMBL7748074

SCHEMBL7748074

NS(=O)(=O)C1Cc2ccccc2O1

nearest known ligand 0.44

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CA2 P00918 8/20 0.44
CA1 P00915 2/20 0.42
AOC2 O75106 5/20 0.40
MAOA P21397 5/20 0.40
MAOB P27338 5/20 0.40
DAO P14920 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
PTGES2 Q9H7Z7 1/20 0.38
NISCH Q9Y2I1 1/20 0.38
CHRM2 P08172 1/20 0.36
CHRM4 P08173 1/20 0.36
CHRM5 P08912 1/20 0.36
CHRM1 P11229 1/20 0.36
CHRM3 P20309 1/20 0.36
DYRK1A Q13627 1/20 0.36

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
SCHEMBL6591026 0.82 CA2 (0.56) CA2CA1NISCH
SCHEMBL7477080 0.82 CA2 (0.40) CA2CA1AOC2MAOAMAOB
SCHEMBL5981402 0.81 HPGD (0.40) CA2CA1AOC2MAOAMAOB
SCHEMBL11072331 0.81 HPGD (0.43) CA2AOC2MAOAMAOBDAO
SCHEMBL30084102 0.81 HPGD (0.40) CA2CA1AOC2MAOAMAOB
SCHEMBL10840184 0.79 SMN1; SMN2 (0.50) CA2CA1MAOAMAOBTSHR
SCHEMBL28897275 0.75 CA2 (0.38) CA2CA1AOC2MAOAMAOB
SCHEMBL5864109 0.74 CA2 (0.54) CA2CA1NISCH
SCHEMBL30132282 0.73 HPGD (0.34) CA2CA1AOC2MAOAMAOB
SCHEMBL18208033 0.70 NISCH (0.43) CA2HPGDNISCH

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4906287-A Herbicidal compounds FMC CORPORATION (US) 1990-03-06 US claimed
EP-0929540-A4 ANTITUMOR COMPOSITIONS AND METHODS OF TREATMENT LILLY CO ELI (US) 2001-12-12 EP disclosed
EP-0929540-A1 ANTITUMOR COMPOSITIONS AND METHODS OF TREATMENT ELI LILLY AND COMPANY (US) 1999-07-21 EP disclosed
US-5827879-A SUBSTITUTED 2,3-DIHYDROBENOFURYL SULFONAMIDE DERIVATIVES ELI LILLY AND COMPANY (US) 1998-10-27 US disclosed
WO-1998014440-A1 ANTITUMOR COMPOSITIONS AND METHODS OF TREATMENT ELI LILLY AND COMPANY (US) 1998-04-09 WO disclosed
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
EP-0123303-A1 Dihydro-benzofuran derivatives having herbicide activity Montedison S.p.A. (IT) 1984-10-31 EP disclosed