SCHEMBL1413066

SCHEMBL1413066

Cc1ccc(S(=O)(=O)Nc2ccc3cc(S(=O)(=O)O)cc(O)c3c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NT5E P21589 2/20 0.57
NSD2 O96028 2/20 0.57
DUSP3 P51452 1/20 0.57
PTPN5 P54829 1/20 0.57
CASP7 P55210 1/20 0.57
CASP6 P55212 1/20 0.57
PTPN11 Q06124 1/20 0.57
SNCA P37840 2/20 0.57
ESR1 P03372 1/20 0.51
CYP19A1 P11511 1/20 0.51
CYP1A2 P05177 1/20 0.50
CYP2C9 P11712 1/20 0.50
HSD17B1 P14061 1/20 0.49
HSD17B2 P37059 1/20 0.49
LMNA P02545 3/20 0.49
ALDH1A1 P00352 2/20 0.49
SMN1; SMN2 Q16637 2/20 0.49
HKDC1 Q2TB90 1/20 0.49
MEN1 O00255 2/20 0.48
KMT2A Q03164 2/20 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
SCHEMBL11671398 0.91 PRMT1 (0.59) NSD2DUSP3PTPN5CASP6PTPN11
SCHEMBL10823372 0.87 NT5E (0.66) NT5ENSD2DUSP3PTPN5CASP7
SCHEMBL8100276 0.87 NSD2 (0.71) NT5ENSD2DUSP3PTPN5CASP7
SCHEMBL10823488 0.86 PRMT1 (0.64) NT5ENSD2DUSP3PTPN5CASP7
SCHEMBL11511934 0.85 CASP6 (0.78) NT5ENSD2DUSP3PTPN5CASP7
SCHEMBL27676540 0.84 NT5E (0.57) NT5ENSD2DUSP3PTPN5CASP7
SCHEMBL10823705 0.83 NT5E (0.53) NT5ENSD2DUSP3PTPN5CASP7
SCHEMBL8110465 0.82 CASP6 (0.64) NT5ENSD2DUSP3PTPN5CASP7
SCHEMBL8440189 0.81 NT5E (0.70) NT5ENSD2DUSP3PTPN5CASP7
SCHEMBL4651295 0.81 CASP6 (0.69) NT5ENSD2DUSP3PTPN5CASP7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8382857-B2 Method for the reactive coloration of leather BASF SE (DE) 2013-02-26 US disclosed
US-8372161-B2 Method for the reactive coloring of leather BASF SE (DE) 2013-02-12 US disclosed
EP-1682717-B1 METHOD FOR THE REACTIVE COLOURING OF LEATHER, DYESTUFFS AND THEIR USE BASF SE (DE) 2011-03-16 EP disclosed
EP-1756355-B1 METHOD FOR THE REACTIVE COLORATION OF LEATHER BASF SE (DE) 2010-08-25 EP disclosed
US-20070234488-A1 Method for the Reactive Coloration of Leather BASF AKTIENGESELLSCHAFT (DE) 2007-10-11 US disclosed
EP-1756355-A1 METHOD FOR THE REACTIVE COLORATION OF LEATHER BASF AKTIENGESELLSCHAFT (DE) 2007-02-28 EP disclosed
US-20070033746-A1 Method for the reactive coloring of leather BASF AKTIENGESSELLSCHAFT (DE) 2007-02-15 US disclosed
EP-1682717-A1 METHOD FOR THE REACTIVE COLOURING OF LEATHER BASF Aktiengesellschaft (DE) 2006-07-26 EP disclosed
WO-2005121439-A1 METHOD FOR THE REACTIVE COLORATION OF LEATHER BASF AKTIENGESELLSCHAFT (DE) 2005-12-22 WO disclosed
WO-2005040490-A1 METHOD FOR THE REACTIVE COLOURING OF LEATHER BASF AKTIENGESELLSCHAFT (DE) 2005-05-06 WO disclosed
US-6015885-A COLOR-STABLE, WATERPROOF DYES FOR NATURAL FIBERS OR REGENERATED CELLULOSE SUMITOMO CHEMICAL COMPANY, LIMITED (JP) 2000-01-18 US disclosed