SCHEMBL9155276

SCHEMBL9155276

NCc1cc(S(=O)(=O)O)c(N)cc1S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TTR P02766 1/20 0.36
NQO1 P15559 1/20 0.36
CTDSP1 Q9GZU7 1/20 0.35
ALDH1A1 P00352 7/20 0.33
HSD17B10 Q99714 4/20 0.33
TDP1 Q9NUW8 3/20 0.33
CASP6 P55212 2/20 0.33
CASP1 P29466 1/20 0.33
CASP7 P55210 1/20 0.33
CYP2C9 P11712 1/20 0.33
CYP2C19 P33261 1/20 0.33
RAPGEF4 Q8WZA2 1/20 0.32
AURKA O14965 1/20 0.32
AURKB Q96GD4 1/20 0.32
CA2 P00918 2/20 0.31
NT5E P21589 2/20 0.31
TSHR P16473 2/20 0.31
CA12 O43570 1/20 0.31
CA1 P00915 1/20 0.31
CA3 P07451 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
SCHEMBL7756170 0.84 CTDSP1 (0.41) TTRNQO1CTDSP1ALDH1A1HSD17B10
SCHEMBL9155359 0.83 CTDSP1 (0.38) TTRNQO1CTDSP1ALDH1A1HSD17B10
SCHEMBL1412987 0.82 TTR (0.46) TTRNQO1CTDSP1ALDH1A1HSD17B10
SCHEMBL9167433 0.82 TTR (0.35) TTRNQO1CTDSP1ALDH1A1HSD17B10
SCHEMBL28567480 0.80 TTR (0.45) TTRNQO1CTDSP1ALDH1A1HSD17B10
SCHEMBL9153355 0.79 BRD4 (0.40) TTRNQO1CTDSP1ALDH1A1HSD17B10
Nitrogen SCHEMBL28715481 0.78 TTR (0.43) TTRNQO1CTDSP1ALDH1A1HSD17B10
SCHEMBL10870494 0.78 TTR (0.43) TTRNQO1CTDSP1ALDH1A1HSD17B10
SCHEMBL9449428 0.77 BRD4 (0.41) TTRNQO1CTDSP1ALDH1A1HSD17B10
SCHEMBL8213587 0.76 CTDSP1 (0.41) TTRNQO1CTDSP1ALDH1A1HSD17B10

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-0356931-B1 Anthrapyridone compounds having vinylsulfone type fiber reactive group through triazinyl bridging group SUMITOMO CHEMICAL CO (JP) 1995-01-18 EP disclosed
EP-0276686-B1 ANTHRAQUINONE COMPOUND AND DYEING OR PRINTING METHOD USING THE SAME SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1991-09-04 EP disclosed
US-4977261-A FIBER-REACTIVE DYES SUMITOMO CHEMICAL COMPANY, LTD. (JP) 1990-12-11 US disclosed
US-4975094-A Anthrapyridone compounds having vinylsulfone type fiber reactive group through triazinyl bridging group SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-12-04 US disclosed
EP-0356931-A2 Anthrapyridone compounds having vinylsulfone type fiber reactive group through triazinyl bridging group SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1990-03-07 EP disclosed
EP-0276686-A2 Anthraquinone compound and dyeing or printing method using the same SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 1988-08-03 EP disclosed