SCHEMBL7068249

SCHEMBL7068249

Nc1[c]ccc2cc(S(=O)(=O)O)cc(O)c12

nearest known ligand 0.57

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NT5E P21589 3/20 0.57
CASP6 P55212 4/20 0.49
NSD2 O96028 3/20 0.49
DUSP3 P51452 2/20 0.49
PTPN5 P54829 2/20 0.49
PTPN11 Q06124 2/20 0.49
ALDH1A1 P00352 4/20 0.45
HSD17B10 Q99714 4/20 0.45
CYP2C9 P11712 2/20 0.44
CYP2C19 P33261 2/20 0.44
APEX1 P27695 1/20 0.41
CYP1A2 P05177 1/20 0.41
HIF1A Q16665 1/20 0.40
PRMT1 Q99873 2/20 0.39
PTPN1 P18031 2/20 0.39
CTDSP1 Q9GZU7 1/20 0.39
TSHR P16473 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
ENPP2 Q13822 1/20 0.38
DUSP5 Q16690 1/20 0.37

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
SCHEMBL11491211 0.84 SUMO2 (0.48) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL11315411 0.78 CASP6 (0.54) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL2470360 0.75 NT5E (0.61) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL3928588 0.74 NT5E (0.70) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL31336134 0.74 NT5E (0.70) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL27153180 0.74 NT5E (0.65) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL7791017 0.74 NT5E (0.65) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL564558 0.73 NT5E (0.74) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL11502500 0.73 NT5E (0.74) NT5ECASP6NSD2DUSP3PTPN5
SCHEMBL66310 0.73 NT5E (0.74) NT5ECASP6NSD2DUSP3PTPN5

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-0765965-B1 Process for deying synthetic fibrous polyamid materials DYSTAR TEXTILFARBEN GMBH & CO (DE) 2003-06-04 EP disclosed
EP-0765918-B1 Reactive dye preparations DYSTAR TEXTILFARBEN GMBH & CO (DE) 1999-07-28 EP disclosed
US-5810890-A USING SPECIFIED MIXTURE OF DYES; INCREASED BRIGHTNESS AND LEVELNESS DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-09-22 US disclosed
US-5803930-A MIXTURE OF TWO DIFFERENT WATER SOLUBLE DYES; DYEING SYNTHETIC POLYAMIDES DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 1998-09-08 US disclosed
EP-0765918-A2 Reactive dye preparations DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1997-04-02 EP disclosed
EP-0765965-A2 Process for deying synthetic fibrous polyamid materials DyStar Textilfarben GmbH & Co. Deutschland KG (DE) 1997-04-02 EP disclosed