SCHEMBL13340636

SCHEMBL13340636

COc1ccc(S(=O)(=O)CCOSOOO)cc1/N=N/c1c(N)ccc2c(O)c(/N=N/c3ccc(S(=O)(=O)CCOSOOO)cc3)c(SOOO)cc12

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ ENPP2 Q13822 2/20 0.35
▸ PTGS1 P23219 3/20 0.35
▸ MEN1 O00255 2/20 0.33
▸ MAPT P10636 2/20 0.33
▸ KMT2A Q03164 2/20 0.33
▸ KDM4E B2RXH2 1/20 0.33
▸ NPC1 O15118 1/20 0.33
▸ HTT P42858 1/20 0.33
▸ RAB9A P51151 1/20 0.33
▸ SMN1; SMN2 Q16637 1/20 0.33
▸ TDP1 Q9NUW8 1/20 0.33
▸ PTGS2 P35354 3/20 0.33
▸ THRB P10828 1/20 0.33
▸ CA1 P00915 3/20 0.32
▸ CA2 P00918 3/20 0.32
▸ ALDH1A1 P00352 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ PKM P14618 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ CDK1 P06493 2/20 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
SCHEMBL13340577 1.00 ENPP2 (0.35) ENPP2PTGS1MEN1MAPTKMT2A
SCHEMBL13340935 0.97 ENPP2 (0.37) ENPP2PTGS1MEN1MAPTKMT2A
SCHEMBL13341006 0.92 ENPP2 (0.40) ENPP2MEN1MAPTKMT2AKDM4E
SCHEMBL13340642 0.92 ENPP2 (0.40) ENPP2MEN1MAPTKMT2AKDM4E
SCHEMBL13340583 0.92 THRB (0.34) ENPP2PTGS1MEN1MAPTKMT2A
SCHEMBL12053274 0.92 ENPP2 (0.39) ENPP2MEN1MAPTKMT2AKDM4E
SCHEMBL13341029 0.92 ENPP2 (0.39) ENPP2MEN1MAPTKMT2AKDM4E
SCHEMBL13340993 0.91 PTPN1 (0.38) ENPP2PTGS1MEN1MAPTKMT2A
SCHEMBL12053267 0.91 THRB (0.38) MEN1MAPTKMT2ATHRBCA2
SCHEMBL13340622 0.89 THRB (0.36) ENPP2THRBCA2PHLPP2

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-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
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