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Sugi Predict / Compounds / SCHEMBL13341070

SCHEMBL13341070

SCHEMBL13341070

[C-]#[N+]Nc1nc(Cl)nc(Nc2ccc(S(=O)(=O)O)c(/N=N/c3c(N)ccc4c(O)c(/N=N/c5ccc(S(=O)(=O)CCOSOOO)cc5S(=O)(=O)O)c(SOOO)cc34)c2)n1

nearest known ligand 0.34

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.34
▸ CARM1 Q86X55 1/20 0.31
▸ PRMT1 Q99873 1/20 0.31
▸ ENPP2 Q13822 1/20 0.30

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
SCHEMBL13341042 0.94 FUT8 (0.36) FUT8CARM1PRMT1ENPP2
SCHEMBL13341049 0.92 FUT8 (0.36) FUT8CARM1PRMT1ENPP2
SCHEMBL12053285 0.92 FUT8 (0.36) FUT8CARM1PRMT1ENPP2
SCHEMBL13340667 0.92 FUT8 (0.35) FUT8CARM1PRMT1ENPP2
SCHEMBL13340668 0.91 FUT8 (0.34) FUT8CARM1PRMT1
SCHEMBL13341036 0.87 ENPP2 (0.32) FUT8ENPP2
SCHEMBL14362766 0.86 FUT8 (0.36) FUT8CARM1PRMT1ENPP2
SCHEMBL13340654 0.85 FUT8 (0.36) FUT8CARM1PRMT1
SCHEMBL13599565 0.84 ENPP2 (0.30) ENPP2
SCHEMBL12053322 0.84 FUT8 (0.36) FUT8CARM1PRMT1

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-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
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