SCHEMBL2587316

SCHEMBL2587316

Nc1ccc2cccc(-c3ccccc3)c2c1S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
HSD17B10 Q99714 3/20 0.39
SLC9A1 P19634 2/20 0.38
DAPK1 P53355 1/20 0.37
PTGS2 P35354 1/20 0.36
TTR P02766 1/20 0.36
FABP4 P15090 1/20 0.36
CCNA2 P20248 1/20 0.36
CDK2 P24941 1/20 0.36
MAPK14 Q16539 1/20 0.36
NR4A1 P22736 1/20 0.35
CDK4 P11802 1/20 0.35
CCND1 P24385 1/20 0.35
CES2 O00748 1/20 0.35
BCHE P06276 1/20 0.35
CES1 P23141 1/20 0.35
MCL1 Q07820 1/20 0.35
CASP1 P29466 2/20 0.35
CASP7 P55210 2/20 0.35
CYP3A4 P08684 1/20 0.35

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
SCHEMBL28065857 0.78 TTR (0.47) ALDH1A1HSD17B10TTRFABP4CCNA2
SCHEMBL11535005 0.78 AURKA (0.53) ALDH1A1HSD17B10DAPK1TTRCCNA2
SCHEMBL27420816 0.76 DAPK1 (0.41) ALDH1A1HSD17B10SLC9A1DAPK1PTGS2
SCHEMBL11158822 0.76 TTR (0.55) ALDH1A1HSD17B10PTGS2TTRFABP4
SCHEMBL31490474 0.76 TTR (0.55) ALDH1A1HSD17B10PTGS2TTRFABP4
SCHEMBL21794264 0.74 TSHR (0.46) ALDH1A1HSD17B10SLC9A1DAPK1PTGS2
SCHEMBL9275088 0.73 TTR (0.49) TTRFABP4CCNA2CDK2MAPK14
SCHEMBL1668346 0.73 TTR (0.49) ALDH1A1HSD17B10TTRFABP4CCNA2
SCHEMBL29375963 0.73 ALDH1A1 (0.60) ALDH1A1HSD17B10CES2BCHECES1
SCHEMBL9118621 0.73 ALDH1A1 (0.60) ALDH1A1HSD17B10CES2BCHECES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2566941-B1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2016-12-21 EP disclosed
CN-102884166-B Dyes and blends for coloring in laundry processes BASF SE 2014-11-26 CN disclosed
US-20130247309-A1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2013-09-26 US disclosed
EP-2566941-A1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2013-03-13 EP disclosed
CN-101891967-B Method for the reactive colouring of leather BASF SE 2013-02-27 CN disclosed
CN-102884166-A Dyes and blends for coloring in laundry processes BASF SE 2013-01-16 CN disclosed
WO-2011138183-A1 DYES AND BLENDS FOR SHADING DURING LAUNDRY BASF SE (DE) 2011-11-10 WO disclosed
CN-101891967-A The reactive staining method of leather BASF AG 2010-11-24 CN disclosed
CN-1965125-B Method for the reactive coloration of leather BASF AG 2010-06-09 CN disclosed
CN-1875144-B Reactive colouring of leather BASF AG 2010-05-26 CN disclosed
CN-1965125-A Method for the reactive coloration of leather BASF AG (DE) 2007-05-16 CN disclosed
CN-1875144-A Reactive colouring of leather BASF AG (DE) 2006-12-06 CN disclosed