SCHEMBL9128043

SCHEMBL9128043

Nc1cc(S(=O)(=O)O)c(Cl)cc1Cl

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.48
HSD17B10 Q99714 4/20 0.48
CASP1 P29466 2/20 0.48
CYP3A4 P08684 1/20 0.48
THRB P10828 1/20 0.48
HPGD P15428 1/20 0.48
ALOX15 P16050 1/20 0.48
TSHR P16473 1/20 0.48
RECQL P46063 1/20 0.48
GAA P10253 1/20 0.46
CA1 P00915 7/20 0.45
CA2 P00918 7/20 0.45
CA9 Q16790 6/20 0.45
CA12 O43570 5/20 0.45
CA7 P43166 5/20 0.45
CA14 Q9ULX7 5/20 0.45
CA4 P22748 4/20 0.45
CA6 P23280 4/20 0.45
CA5A P35218 4/20 0.45
CA5B Q9Y2D0 4/20 0.45

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
SCHEMBL29516458 0.91 GAA (0.52) ALDH1A1HSD17B10CASP1CYP3A4THRB
SCHEMBL1708535 0.91 GAA (0.52) ALDH1A1HSD17B10CASP1CYP3A4THRB
SCHEMBL11284975 0.89 GAA (0.50) ALDH1A1HSD17B10CASP1CYP3A4THRB
SCHEMBL11284960 0.89 GAA (0.50) ALDH1A1HSD17B10CASP1CYP3A4THRB
Hydrochloric Acid SCHEMBL11242082 0.89 GAA (0.50) ALDH1A1HSD17B10CASP1CYP3A4THRB
SCHEMBL9327134 0.89 ALDH1A1 (0.50) ALDH1A1HSD17B10CASP1CYP3A4THRB
Nitrogen SCHEMBL11697308 0.88 GAA (0.48) ALDH1A1HSD17B10CASP1CYP3A4THRB
SCHEMBL7029578 0.87 GAA (0.52) ALDH1A1HSD17B10CASP1CYP3A4THRB
SCHEMBL9328432 0.87 CA1 (0.50) ALDH1A1HSD17B10CASP1CYP3A4THRB
SCHEMBL5443614 0.84 CA1 (0.43) ALDH1A1HSD17B10CASP1CYP3A4THRB

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
US-5476923-A Pigmenting a substrate SANDOZ LTD. (CH) 1995-12-19 US disclosed
EP-0202906-B1 PROCESS FOR PRODUCING AZO LAKE PIGMENTS DAINIPPON INK AND CHEMICALS, INC. (JP) 1989-01-25 EP disclosed
US-4767844-A COUPLING DIAZO COMPONENT HAVING SULFONIC ACID GROUP WITH A MIXTURE OF 2-HYDROXY-3-NAPHTHOIC ACID AND THE AMIDE DERIVATIVES THEREOF DAINIPPON INK AND CHEMICALS, INC. (JP) 1988-08-30 US disclosed
US-4652633-A YELLOW AZO DYES BASF AKTIENGESELLSCHAFT (DE) 1987-03-24 US disclosed
EP-0202906-A1 Process for producing azo lake pigments DAINIPPON INK AND CHEMICALS, INC. (JP) 1986-11-26 EP disclosed
US-4014866-A FOR SURFACE COATINGS, PRINTING INKS AND RESINS BASF AKTIENGESELLSCHAFT (DT) 1977-03-29 US disclosed