SCHEMBL5711929

SCHEMBL5711929

CC(=O)OCCS(=O)(=O)c1ccc(N)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA2 P00918 4/20 0.54
GAA P10253 2/20 0.50
TSHR P16473 3/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
DHFR P00374 1/20 0.49
TDP1 Q9NUW8 1/20 0.49
ALDH1A1 P00352 5/20 0.45
KMT2A Q03164 3/20 0.45
HTT P42858 2/20 0.45
LMNA P02545 2/20 0.45
PKM P14618 1/20 0.45
CYP2C19 P33261 1/20 0.45
MEN1 O00255 1/20 0.45
CA12 O43570 1/20 0.44
CA1 P00915 1/20 0.44
CA9 Q16790 1/20 0.44
F2 P00734 1/20 0.41
PRSS1 P07477 1/20 0.41
PRSS2 P07478 1/20 0.41
PRSS3 P35030 1/20 0.41

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
SCHEMBL15833291 0.85 CA2 (0.51) CA2GAATSHRSMN1; SMN2ALDH1A1
SCHEMBL4067415 0.85 ALDH1A1 (0.56) CA2GAAALDH1A1KMT2AHTT
SCHEMBL28621564 0.85 GAA (0.47) CA2GAATSHRSMN1; SMN2DHFR
SCHEMBL8752139 0.83 CA2 (0.54) CA2GAASMN1; SMN2ALDH1A1KMT2A
SCHEMBL12237305 0.83 GAA (0.51) CA2GAAALDH1A1KMT2AHTT
SCHEMBL12237322 0.83 CA2 (0.53) CA2GAASMN1; SMN2ALDH1A1KMT2A
SCHEMBL13434032 0.82 HTT (0.62) CA2GAASMN1; SMN2ALDH1A1KMT2A
SCHEMBL7882865 0.81 CA2 (0.49) CA2TSHRTDP1ALDH1A1HTT
SCHEMBL9559059 0.80 CA2 (0.48) CA2GAAALDH1A1KMT2AHTT
SCHEMBL1373345 0.80 CA2 (0.50) CA2GAASMN1; SMN2ALDH1A1KMT2A

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 72 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-4257770-A MIXTURE OF REACTIVE DYES FOR CELLULOSE FIBERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-03-24 US claimed
JP-55016060-A None JP disclosed
EP-1735286-A1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA N.V. (BE) 2006-12-27 EP disclosed
EP-1352032-B1 DISPERS-REACTIVE DYES CONTAINING ACETOXYMETHYLSULFONE OR VINYLSULFONE AND THEIR PROCESS KOREA RES INST CHEM TECH (KR) 2006-11-02 EP disclosed
US-6992179-B1 Reactive orange dyes containing vinyl sulfones KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2006-01-31 US disclosed
WO-2005095353-A1 TETRAHYDRO-INDAZOLE CANNABINOID MODULATORS JANSSEN PHARMACEUTICA, N.V. (BE) 2005-10-13 WO disclosed
US-6884876-B2 Disperse-reactive dyes containing acetoxyethylsulfone or vinylsulfone and their process KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2005-04-26 US disclosed
EP-1055710-B1 Water-soluble fibre-reactive dyestuffs, process for their preparation and their use DYSTAR TEXTILFARBEN GMBH & CO (DE) 2004-08-11 EP disclosed
US-20040077846-A1 Dispers-reactive dyes containing acetoxymethylsulfone or vinylsulfone and their process KOREA RESEARCH INSTITUTE OF CHEMICAL TECHNOLOGY (KR) 2004-04-22 US disclosed
EP-1352032-A1 DISPERS-REACTIVE DYES CONTAINING ACETOXYMETHYLSULFONE OR VINYLSULFONE AND THEIR PROCESS Korea Research Institute of Chemical Technology (KR) 2003-10-15 EP disclosed
WO-1990013604-A1 WATER-SOLUBLE REACTIVE DYES FOR FIBRES, THEIR PREPARATION AND USE HOECHST AKTIENGESELLSCHAFT (DE) 1990-11-15 WO disclosed
WO-1990013603-A1 WATER-SOLUBLE AZO DYES, PROCESS FOR PRODUCING THEM AND THEIR USE HOECHST AKTIENGESELLSCHAFT (DE) 1990-11-15 WO disclosed
EP-0344343-A1 Process for the regiospecific sulfonation of 2-amino-naphtalenes substituted in the 5- or 7-position by a fibre reactive vs-group, the novel 5-sulfo-substituted fiber-reactive 2-amino-naphthalene, and fibre-reactive azo dyes thereof HOECHST CELANESE CORPORATION (US) 1989-12-06 EP disclosed
US-4482501-A REACTING AN AMINOARYL- OR AMIDOARYL-B- HYDROXYLETHYLSULFONE WITH SULFURIC ACID SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1984-11-13 US disclosed
EP-0085025-A2 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1983-08-03 EP disclosed
US-4346046-A FROM AMINOARYL-B-HYDROXYETHYLSULFONE AND SULFURIC ACID SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1982-08-24 US disclosed
EP-0056975-A2 Water soluble monoazocompounds, process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1982-08-04 EP disclosed
US-4257770-A MIXTURE OF REACTIVE DYES FOR CELLULOSE FIBERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-03-24 US disclosed
US-4257770-A MIXTURE OF REACTIVE DYES FOR CELLULOSE FIBERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1981-03-24 US disclosed
JP-S5516060-A PREPARATION OF DISAZO DYE SUMITOMO CHEM CO LTD 1980-02-04 JP disclosed