SCHEMBL7380869

SCHEMBL7380869

O=[C]c1cccc(S(=O)(=O)Cl)c1

nearest known ligand 0.48

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.48
HSD17B10 Q99714 2/20 0.48
TDP1 Q9NUW8 2/20 0.48
CA1 P00915 9/20 0.44
CA2 P00918 9/20 0.44
CA12 O43570 8/20 0.44
CA9 Q16790 8/20 0.44
CA14 Q9ULX7 2/20 0.44
ALOX5 P09917 1/20 0.33
LMNA P02545 1/20 0.33
MCOLN3 Q8TDD5 1/20 0.33
CA4 P22748 1/20 0.32
PGR P06401 1/20 0.32
TSHR P16473 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
SCHEMBL31672139 0.82 CA1 (0.67) ALDH1A1HSD17B10TDP1CA1CA2
SCHEMBL65861 0.82 ENPP2 (0.50) ALDH1A1HSD17B10TDP1CA1CA2
SCHEMBL10247631 0.82 CA1 (0.67) ALDH1A1HSD17B10TDP1CA1CA2
SCHEMBL56599 0.79 ALDH1A1 (0.65) ALDH1A1HSD17B10TDP1CA1CA2
SCHEMBL17161327 0.79 CA2 (0.44) CA1CA2CA12CA9CA14
SCHEMBL5441030 0.79 PTGS2 (0.47) ALDH1A1HSD17B10CA1CA2CA12
SCHEMBL5717991 0.79 TSHR (0.53) ALDH1A1HSD17B10TDP1CA1CA2
SCHEMBL9836866 0.79 CA2 (0.69) CA1CA2CA12CA9CA14
SCHEMBL7721926 0.78 ALDH1A1 (0.39) ALDH1A1HSD17B10TDP1
SCHEMBL7192772 0.76 CA1 (0.42) CA1CA2CA12CA9CA14

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0154811-A2 Coupling agents between mineral fillers and polymers Plüss-Staufer AG (CH) 1985-09-18 EP claimed
WO-1985003505-A2 COUPLING AGENT BETWEEN MINERAL FILLERS AND POLYMERS PLÜSS-STAUFER AG (CH) 1985-08-15 WO claimed
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-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
EP-0154811-A2 Coupling agents between mineral fillers and polymers Plüss-Staufer AG (CH) 1985-09-18 EP disclosed