SCHEMBL13340622

SCHEMBL13340622

Nc1ccc2c(O)c(/N=N/c3ccc(S(=O)(=O)CCOSOOO)cc3)c(SOOO)cc2c1/N=N/c1cc(S(=O)(=O)CCOSOOO)ccc1S(=O)(=O)O

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.36
▸ SENP2 Q9HC62 6/20 0.34
▸ SUMO2 P61956 4/20 0.34
▸ SUMO1 P63165 4/20 0.34
▸ SENP7 Q9BQF6 4/20 0.34
▸ CYP2C9 P11712 1/20 0.33
▸ CYP2C19 P33261 1/20 0.33
▸ HSD17B10 Q99714 1/20 0.33
▸ ENPP2 Q13822 4/20 0.33
▸ CA2 P00918 1/20 0.32
▸ CA3 P07451 1/20 0.32
▸ SENP1 Q9P0U3 5/20 0.32
▸ SENP3 Q9H4L4 4/20 0.32
▸ CYP1A2 P05177 1/20 0.32
▸ PTPN11 Q06124 1/20 0.32
▸ PHLPP2 Q6ZVD8 1/20 0.31
▸ CD40 P25942 1/20 0.31
▸ CD40LG P29965 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
SCHEMBL12053326 0.95 PTPN11 (0.37) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL12053276 0.94 ENPP2 (0.37) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL12052926 0.94 ENPP2 (0.37) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL13341064 0.93 ENPP2 (0.36) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL12053267 0.91 THRB (0.38) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL13340642 0.91 ENPP2 (0.40) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL13341006 0.91 ENPP2 (0.40) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL13340621 0.89 SENP2 (0.37) SENP2SUMO2SUMO1SENP7CYP2C9
SCHEMBL13340577 0.89 ENPP2 (0.35) THRBENPP2CA2PHLPP2
SCHEMBL13340636 0.89 ENPP2 (0.35) THRBENPP2CA2PHLPP2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7708786-B2 Dye mixtures of fiber-reactive azo dyes, their preparation and use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2010-05-04 — — US disclosed
US-7637964-B2 Dye mixtures of fiber-reactive azo dyes, their preparation and their use DYSTAR TEXTILFARBEN GMBH & CO. (DE) 2009-12-29 — — US disclosed
US-20090025152-A1 DYE MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND USE DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2009-01-29 — — US disclosed
US-7455699-B2 Dye mixtures of fiber-reactive azo dyes, their preparation and use DYSTAR TEXILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-11-25 — — US disclosed
US-20080274287-A1 Dye Mixtures Of Fiber-Reactive Azo Dyes, Their Preparation And Their Use DYSTAR TEXTILFARBEN GMBH & CO. DEUTSCHLAND KG (DE) 2008-11-06 — — US disclosed
US-7429279-B2 Dye mixtures of fiber-reactive AZO dyes, their preparation and their use DYSTAR TEXTILFARBEN GMBH + CO. DEUTSCHLAND KG (DE) 2008-09-30 — — US disclosed
US-20070271711-A1 Dye Mixtures of Fibre-Reactive Azo Dyes Production and Use Thereof DYSTAR TEXTILFARBEN GMBH & CO., DEUTSCHLAND KG (DE) 2007-11-29 — — US disclosed
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