SCHEMBL7759866

SCHEMBL7759866

C=CS(=O)(=O)CCC[N]c1cccc(S(=O)(=O)O)c1

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 3/20 0.38
TSHR P16473 2/20 0.38
ALDH1A1 P00352 1/20 0.38
HSD17B10 Q99714 1/20 0.38
SENP3 Q9H4L4 2/20 0.38
SENP2 Q9HC62 2/20 0.38
SENP1 Q9P0U3 2/20 0.38
SUMO2 P61956 1/20 0.38
SUMO1 P63165 1/20 0.38
SENP7 Q9BQF6 1/20 0.38
KMT2A Q03164 2/20 0.37
GAA P10253 1/20 0.37
MAPT P10636 1/20 0.37
MAPK1 P28482 1/20 0.37
CA2 P00918 6/20 0.35
CA9 Q16790 6/20 0.35
CA7 P43166 4/20 0.35
CA1 P00915 3/20 0.35
POLB P06746 1/20 0.34
CYP2D6 P10635 1/20 0.34

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
SCHEMBL7838580 0.92 SENP3 (0.42) TDP1TSHRALDH1A1HSD17B10SENP3
SCHEMBL7839760 0.82 TDP1 (0.43) TDP1TSHRALDH1A1KMT2APOLB
SCHEMBL7760688 0.81 CA2 (0.33) CA2POLBCYP2D6
SCHEMBL7839508 0.80 TDP1 (0.37) TDP1TSHRALDH1A1HSD17B10SENP3
SCHEMBL9627414 0.77 TDP1 (0.46) TDP1TSHRALDH1A1HSD17B10SENP3
SCHEMBL6240592 0.76 TSHR (0.47) TDP1TSHRALDH1A1HSD17B10SENP3
SCHEMBL7803303 0.73 SENP3 (0.41) TDP1TSHRALDH1A1HSD17B10SENP3
SCHEMBL7843599 0.73 TDP1 (0.46) TDP1TSHRALDH1A1HSD17B10SENP2
SCHEMBL7759859 0.72 CA1 (0.40) TDP1TSHRALDH1A1HSD17B10CA2
SCHEMBL7840012 0.72 CA12 (0.33) ALDH1A1MAPK1CA2CA9CA1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0697443-B1 Triphendioxazine reactive dyes DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-04-04 EP claimed
EP-0697443-A2 Triphendioxazine reactive dyes HOECHST AKTIENGESELLSCHAFT (DE) 1996-02-21 EP claimed
EP-0675172-B1 Water-solable azo compounds, process for their preparation and their use as dyestuffs DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-04-11 EP disclosed
EP-0697443-B1 Triphendioxazine reactive dyes DYSTAR TEXTILFARBEN GMBH & CO (DE) 2001-04-04 EP disclosed
US-5770709-A BRILLIANT COLOR SHADES, GOOD FASTNESS DURING USE AT HIGH DEGREE OF FIXING DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 1998-06-23 US disclosed
EP-0629667-B1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AG (DE) 1998-02-25 EP disclosed
US-5539088-A PROVIDE DYEINGS IN BRILLIANT SHADES WITH GOOD FASTNESS PROPERTIES AND HIGH DEGREE OF FIXATION HOECHST AKTIENGESELLSCHAFT (DE) 1996-07-23 US disclosed
EP-0697443-A2 Triphendioxazine reactive dyes HOECHST AKTIENGESELLSCHAFT (DE) 1996-02-21 EP disclosed
EP-0629667-A1 Water-soluble fiber-reactive dyes, process for their preparation and the use thereof HOECHST AKTIENGESELLSCHAFT (DE) 1994-12-21 EP disclosed