SCHEMBL13599484

SCHEMBL13599484

O=S(=O)(O)c1cc(Nc2nc(Cl)nc(Nc3cc(S(=O)(=O)O)cc4cc(S(=O)(=O)O)c(/N=N/c5ccc(S(=O)(=O)CCOSOOO)cc5)c(O)c34)n2)c2c(O)c(/N=N/c3ccc(S(=O)(=O)CCOSOOO)cc3)c(SOOO)cc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.52
▸ ENPP2 Q13822 6/20 0.39
▸ THRB P10828 1/20 0.39
▸ PRMT1 Q99873 3/20 0.35
▸ CARM1 Q86X55 1/20 0.35
▸ PHLPP2 Q6ZVD8 1/20 0.35
▸ CA2 P00918 1/20 0.34
▸ CA3 P07451 1/20 0.34
▸ CYP1A2 P05177 2/20 0.32
▸ CYP2C9 P11712 1/20 0.32
▸ MAPK1 P28482 1/20 0.32
▸ DNASE1L3 Q13609 1/20 0.32
▸ CD40 P25942 1/20 0.31
▸ CD40LG P29965 1/20 0.31
▸ MEN1 O00255 1/20 0.31
▸ HTT P42858 1/20 0.31
▸ KMT2A Q03164 1/20 0.31
▸ SUMO2 P61956 1/20 0.31
▸ SUMO1 P63165 1/20 0.31
▸ SENP7 Q9BQF6 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
SCHEMBL13599537 0.93 FUT8 (0.49) FUT8ENPP2THRBPRMT1CARM1
SCHEMBL14012420 0.93 FUT8 (0.43) FUT8ENPP2THRBPRMT1CARM1
SCHEMBL13599496 0.92 FUT8 (0.48) FUT8ENPP2THRBPRMT1CARM1
SCHEMBL13599491 0.91 FUT8 (0.46) FUT8ENPP2THRBPRMT1CARM1
SCHEMBL14075516 0.91 FUT8 (0.43) FUT8ENPP2THRBPRMT1CARM1
SCHEMBL13599524 0.88 FUT8 (0.41) FUT8ENPP2THRBPRMT1CARM1
SCHEMBL14379262 0.84 FUT8 (0.40) FUT8ENPP2
SCHEMBL13420845 0.83 FUT8 (0.50) FUT8ENPP2THRBPRMT1CARM1
SCHEMBL13420617 0.82 FUT8 (0.49) FUT8ENPP2THRBPRMT1CARM1
SCHEMBL16624644 0.81 FUT8 (0.58) FUT8ENPP2THRBPRMT1CARM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
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-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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