SCHEMBL1413097

SCHEMBL1413097

O=S(=O)(O)c1[c]cc2c(O)[c]c(S(=O)(=O)O)cc2c1

nearest known ligand 0.00

⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.

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
SCHEMBL1413187 0.78 NT5E (0.30)
SCHEMBL2210354 0.76 CASP6 (0.47)
SCHEMBL10445260 0.76 CASP6 (0.51)
SCHEMBL6630742 0.75 CYP2D6 (0.44)
SCHEMBL2152539 0.75 CASP6 (0.54)
SCHEMBL1413189 0.75 NSD2 (0.30)
SCHEMBL7068229 0.73 CASP6 (0.34)
SCHEMBL6635390 0.72 HSD17B10 (0.50)
SCHEMBL1966166 0.72 CASP6 (0.39)
SCHEMBL1413136 0.72

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 10 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