SCHEMBL3274288

SCHEMBL3274288

O=[C]c1ccc(S(=O)(=O)Cl)cc1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
HSD17B10 Q99714 1/20 0.50
TDP1 Q9NUW8 1/20 0.50
CA12 O43570 6/20 0.37
CA1 P00915 6/20 0.37
CA2 P00918 6/20 0.37
CA9 Q16790 6/20 0.37
CA4 P22748 3/20 0.37
CA14 Q9ULX7 3/20 0.37
CYP3A4 P08684 1/20 0.33
MAPK1 P28482 1/20 0.33
CA3 P07451 2/20 0.32
CA6 P23280 2/20 0.32
CA5A P35218 2/20 0.32
CA7 P43166 2/20 0.32
CA13 Q8N1Q1 2/20 0.32
CA5B Q9Y2D0 2/20 0.32
TRPV4 Q9HBA0 1/20 0.32
MAOA P21397 1/20 0.31
MAOB P27338 1/20 0.31

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
SCHEMBL651902 0.81 ALDH1A1 (0.71) ALDH1A1HSD17B10TDP1CA12CA1
SCHEMBL16564194 0.78 CA12 (0.61) ALDH1A1HSD17B10TDP1CA12CA1
SCHEMBL61854 0.78 CA1 (0.55) ALDH1A1HSD17B10TDP1CA12CA1
SCHEMBL7721926 0.75 ALDH1A1 (0.39) ALDH1A1HSD17B10TDP1
SCHEMBL3123896 0.75 ENPP2 (0.52)
SCHEMBL4840191 0.75 LMNA (0.54) ALDH1A1HSD17B10TDP1CA12CA1
SCHEMBL866499 0.75 CA2 (0.64) ALDH1A1TDP1CA12CA1CA2
SCHEMBL17161292 0.75 F2 (0.43) CA12CA1CA2CA9CA4
SCHEMBL4377093 0.73 CA12 (0.66) CA12CA1CA2CA9MAOA
SCHEMBL7380869 0.73 ALDH1A1 (0.48) ALDH1A1HSD17B10TDP1CA12CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2097374-B1 5-ALKYLOXY-INDOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPY AS SELECTIVE LIGANDS OF V2 VASOPRESSIN RECEPTORS SANOFI AVENTIS (FR) 2010-06-09 EP disclosed
EP-2097374-A2 5-ALKYLOXY-INDOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPY AS SELECTIVE LIGANDS OF V2 VASOPRESSIN RECEPTORS Sanofi-Aventis (FR) 2009-09-09 EP disclosed
WO-2008087278-A2 5-ALKYLOXY-INDOLIN-2-ONE DERIVATIVES, PREPARATION THEREOF AND APPLICATION THEREOF IN THERAPY AS SELECTIVE LIGANDS OF V2 VASOPRESSIN RECEPTORS SANOFI-AVENTIS (FR) 2008-07-24 WO disclosed
EP-0581939-B1 N-SULPHONYL-2-OXOINDOLE DERIVATIVES HAVING AFFINITY FOR VASOPRESSIN AND/OR OCYTOCIN RECEPTORS SANOFI SA (FR) 1999-06-02 EP disclosed
EP-0636608-A1 Derivatives of 1-benzenesulfonyl-1,3-dihydro-indol-2-one, their preparation and pharmaceutical compositions containing them SANOFI (FR) 1995-02-01 EP disclosed
EP-0581939-A1 N-SULPHONYL-2-OXOINDOLE DERIVATIVES HAVING AFFINITY FOR VASOPRESSIN AND/OR OCYTOCIN RECEPTORS SANOFI (FR) 1994-02-09 EP disclosed
WO-1993015051-A1 N-SULPHONYL-2-OXOINDOLE DERIVATIVES HAVING AFFINITY FOR VASOPRESSIN AND/OR OCYTOCIN RECEPTORS ELF SANOFI (FR) 1993-08-05 WO disclosed