SCHEMBL7758469

SCHEMBL7758469

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

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 4/20 0.52
ALDH1A1 P00352 3/20 0.52
NT5E P21589 1/20 0.52
LMNA P02545 2/20 0.50
MPO P05164 1/20 0.50
CYP3A4 P08684 1/20 0.50
CYP2C9 P11712 1/20 0.50
HTR6 P50406 1/20 0.50
CA1 P00915 4/20 0.48
CA2 P00918 4/20 0.48
CA12 O43570 3/20 0.48
CA9 Q16790 3/20 0.48
TDP1 Q9NUW8 2/20 0.48
AGO2 Q9UKV8 2/20 0.48
CA14 Q9ULX7 2/20 0.48
USP2 O75604 1/20 0.48
CA4 P22748 1/20 0.48
CA6 P23280 1/20 0.48
CA5A P35218 1/20 0.48
CA7 P43166 1/20 0.48

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
SCHEMBL396609 0.82 TSHR (0.54) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL9663541 0.81 NT5E (0.41) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL5335059 0.80 GAA (0.52) ALDH1A1LMNACYP3A4CYP2C9CA1
SCHEMBL8951866 0.78 TSHR (0.50) TSHRALDH1A1NT5ELMNAMPO
SCHEMBL32038 0.78 MMP2 (0.55) CA1CA2CA12CA9CA14
SCHEMBL9646612 0.78 MMP13 (0.34) ALDH1A1CA1CA2CA12CA9
SCHEMBL3369804 0.78 MAPT (0.53) ALDH1A1CYP3A4CYP2C9HTR6CA1
SCHEMBL3328706 0.77 TSHR (0.48) TSHRALDH1A1LMNAHTR6CA1
SCHEMBL8008343 0.76 ALDH1A1 (0.58) TSHRALDH1A1LMNAHTR6CA1
SCHEMBL10646187 0.75 TYR (0.47) ALDH1A1TDP1MMP1MMP2MMP9

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1086180-A1 TRISAZO AND POLYAZO DYES AND THE MIXTURES THEREOF BASF AKTIENGESELLSCHAFT (DE) 2001-03-28 EP disclosed
WO-1999064520-A1 TRISAZO AND POLYAZO DYES AND THE MIXTURES THEREOF BASF AKTIENGESELLSCHAFT (DE) 1999-12-16 WO disclosed
US-5847111-A Aluminum phthalocyanine reactive dyes CLARIANT FINANCE (BVI) LIMITED (VG) 1998-12-08 US disclosed
US-5760215-A BASED ON ALUMINUM PHTHALOCYANINE; DYE COTTON BRILLIANT GREEN COLORFAST SHADES CLARIANT FINANCE (BVI) LIMITED (VG) 1998-06-02 US disclosed
US-5488101-A DYES WITH NAPHTHOL GROUPS FOR IMAGES AND FIBERS SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1996-01-30 US disclosed
US-5463031-A Printing, dyeing cellulose and organonitrogen compounds BAYER AKTIENGESELLSCHAFT (DE) 1995-10-31 US disclosed
EP-0345577-B1 Reactive dyes BAYER AG (DE) 1993-12-08 EP disclosed
US-5241057-A Blue shades BAYER AKTIENGESELLSHAFT (DE) 1993-08-31 US disclosed
US-5233026-A For cold, pad-batch process; color and washfastness CIBA-GEIGY CORPORATION (US) 1993-08-03 US disclosed
EP-0518266-A1 Trisazo compounds, method for dyeing fiber materials, paper or leather using the same and inks containing the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1992-12-16 EP disclosed
US-4713082-A Process for dyeing or printing textile fibre materials with reactive dye containing vinyl sulfonyl-type group and chloro-triazinyl amino group CIBA-GEIGY CORPORATION (US) 1987-12-15 US disclosed
US-4576755-A Water-soluble fibre-reactive phthalocyanine compounds HOECHST AKTIENGESELLSCHAFT (DE) 1986-03-18 US disclosed
EP-0174275-A1 Process for dyeing or printing fibrous textile materials with reactive dyes CIBA-GEIGY AG (CH) 1986-03-12 EP disclosed
EP-0134193-A1 Reactive dyes, their preparation and their use CIBA-GEIGY AG (CH) 1985-03-13 EP disclosed
EP-0092909-A2 Process for producing aminophenyl-beta-hydroxyethylsulfone SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1983-11-02 EP disclosed
EP-0090114-A2 Reactive dyes IMPERIAL CHEMICAL INDUSTRIES PLC (GB) 1983-10-05 EP disclosed
EP-0075905-A2 Water-soluble reactive phthalocyanine compounds; process for their preparation and their use as dyestuffs HOECHST AKTIENGESELLSCHAFT (DE) 1983-04-06 EP disclosed
US-4283196-A FIXING BY ACTION OF AN ALKALINE AGENT AMERICAN HOECHST CORPORATION (US) 1981-08-11 US disclosed
US-4271072-A FIBER-REACTIVE, FOR DYEING NATURAL AND SYNTHETIC POLYAMIDES AND CELULOSES AMERICAN HOECHST CORPORATION (US) 1981-06-02 US disclosed
US-3987026-A POLYESTERS CIBA-GEIGY CORPORATION (US) 1976-10-19 US disclosed