SCHEMBL13599566

SCHEMBL13599566

CC(=O)Nc1cc(S(=O)(=O)O)cc2cc(SOOO)c(/N=N/c3cc(Nc4nc(Cl)nc(Nc5ccc(S(=O)(=O)CCOS(=O)(=O)O)cc5)n4)ccc3S(=O)(=O)O)c(O)c12

nearest known ligand 0.51

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.51
▸ ENPP2 Q13822 3/20 0.35
▸ PRMT1 Q99873 2/20 0.32
▸ CARM1 Q86X55 1/20 0.32
▸ POLB P06746 1/20 0.32
▸ P2RX3 P56373 2/20 0.31
▸ USP2 O75604 1/20 0.31
▸ APEX1 P27695 1/20 0.31
▸ CHAT P28329 1/20 0.31
▸ THRB P10828 2/20 0.30
▸ MEN1 O00255 2/20 0.30
▸ KMT2A Q03164 2/20 0.30
▸ KDM4E B2RXH2 1/20 0.30
▸ MAPT P10636 1/20 0.30
▸ HPGD P15428 1/20 0.30
▸ HSD17B10 Q99714 1/20 0.30
▸ TDP1 Q9NUW8 1/20 0.30
▸ P2RX2 Q9UBL9 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
SCHEMBL14372008 0.86 FUT8 (0.49) FUT8ENPP2PRMT1CARM1POLB
SCHEMBL12053489 0.85 THRB (0.46) FUT8ENPP2PRMT1CARM1USP2
SCHEMBL12053499 0.84 FUT8 (0.44) FUT8ENPP2PRMT1CARM1USP2
SCHEMBL13599534 0.84 FUT8 (0.60) FUT8ENPP2PRMT1USP2APEX1
SCHEMBL13998607 0.84 FUT8 (0.54) FUT8ENPP2PRMT1CARM1USP2
SCHEMBL13340681 0.84 CARM1 (0.41) FUT8ENPP2PRMT1CARM1
SCHEMBL14372007 0.84 FUT8 (0.47) FUT8ENPP2
SCHEMBL13538879 0.84 FUT8 (0.53) FUT8ENPP2PRMT1CARM1USP2
SCHEMBL12053476 0.83 THRB (0.46) FUT8ENPP2PRMT1CARM1USP2
SCHEMBL13599496 0.83 FUT8 (0.48) FUT8ENPP2PRMT1CARM1THRB

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-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-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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