SCHEMBL13340681

SCHEMBL13340681

O=S(=O)(O)OCCS(=O)(=O)c1ccc(Nc2nc(F)nc(Nc3ccc(S(=O)(=O)O)c(/N=N/c4c(SOOO)cc5cc(Nc6nc(Cl)nc(Cl)n6)ccc5c4O)c3)n2)cc1

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ CARM1 Q86X55 1/20 0.41
▸ PRMT1 Q99873 1/20 0.41
▸ FUT8 Q9BYC5 1/20 0.40
▸ ENPP2 Q13822 6/20 0.33
▸ CD40 P25942 1/20 0.33
▸ CD40LG P29965 1/20 0.33
▸ CA12 O43570 1/20 0.31
▸ CA1 P00915 1/20 0.31
▸ CA2 P00918 1/20 0.31
▸ CA9 Q16790 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
SCHEMBL13340692 0.88 FUT8 (0.40) CARM1PRMT1FUT8ENPP2CA12
SCHEMBL13949157 0.86 FUT8 (0.41) CARM1PRMT1FUT8ENPP2CD40
SCHEMBL12053346 0.86 FUT8 (0.40) CARM1PRMT1FUT8ENPP2CD40
SCHEMBL13340678 0.84 PRMT1 (0.43) CARM1PRMT1FUT8ENPP2CD40
SCHEMBL13599566 0.84 FUT8 (0.51) CARM1PRMT1FUT8ENPP2
SCHEMBL12053489 0.84 THRB (0.46) CARM1PRMT1FUT8ENPP2CD40
SCHEMBL13340552 0.84 THRB (0.47) FUT8ENPP2CD40CD40LG
SCHEMBL14388920 0.84 FUT8 (0.54) CARM1PRMT1FUT8ENPP2CD40
SCHEMBL12053476 0.83 THRB (0.46) CARM1PRMT1FUT8ENPP2CD40
SCHEMBL12053499 0.83 FUT8 (0.44) CARM1PRMT1FUT8ENPP2

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 3 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-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
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