SCHEMBL12053477

SCHEMBL12053477

Nc1c(/N=N/c2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2)c(S(=O)(=O)O)cc2cc(SOOO)c(/N=N/c3cc(Nc4nc(F)nc(F)c4Cl)ccc3S(=O)(=O)O)c(O)c12

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.46
▸ ENPP2 Q13822 4/20 0.34
▸ FUT8 Q9BYC5 1/20 0.33

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
SCHEMBL13880589 0.93 THRB (0.53) THRBENPP2FUT8
SCHEMBL18832713 0.93 THRB (0.53) THRBENPP2FUT8
SCHEMBL13340552 0.91 THRB (0.47) THRBENPP2FUT8
SCHEMBL12053453 0.90 THRB (0.46) THRBENPP2FUT8
SCHEMBL12053476 0.89 THRB (0.46) THRBENPP2FUT8
SCHEMBL12053489 0.89 THRB (0.46) THRBENPP2FUT8
SCHEMBL13340562 0.86 THRB (0.43) THRBENPP2FUT8
Lithium Ion SCHEMBL15544703 0.85 THRB (0.60) THRBENPP2FUT8
Lithium Ion SCHEMBL15544709 0.85 THRB (0.62) THRBENPP2FUT8
Lithium Ion SCHEMBL15544707 0.85 THRB (0.63) THRBENPP2FUT8

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
US-8080101-B2 Azo reactive dyes and mixtures of fiber-reactive azo dyes, their preparation and their use DYSTAR COLOURS DEUTSCHLAND GMBH (DE) 2011-12-20 — — US disclosed
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-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-20080295732-A1 Azo Reactive Dyes And Mixtures Of Fiber-Reactive Azo Dyes, Their Preparation And Their Use DYSTAR TEXTILFARBEN GMBH &CO. DEUTSCHLAND KG (DE) 2008-12-04 — — 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-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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