SCHEMBL14388920

SCHEMBL14388920

O=S(=O)(O)OCCS(=O)(=O)c1ccc(Nc2nc(Cl)nc(Nc3ccc4c(O)c(/N=N/c5cc(S(=O)(=O)O)ccc5S(=O)(=O)O)c(S(=O)(=O)O)cc4c3)n2)cc1

nearest known ligand 0.54

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.54
▸ PRMT1 Q99873 3/20 0.49
▸ CARM1 Q86X55 1/20 0.49
▸ ENPP2 Q13822 9/20 0.46
▸ CD40 P25942 1/20 0.45
▸ CD40LG P29965 1/20 0.45
▸ MEN1 O00255 1/20 0.40
▸ THRB P10828 1/20 0.40
▸ KMT2A Q03164 1/20 0.40
▸ TDP1 Q9NUW8 1/20 0.40
▸ PRMT3 O60678 1/20 0.39
▸ EP300 Q09472 1/20 0.39
▸ PRMT6 Q96LA8 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ HIF1A Q16665 2/20 0.39
▸ CYP1A2 P05177 1/20 0.39

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
SCHEMBL3698096 0.90 PRMT1 (0.61) FUT8PRMT1CARM1ENPP2CD40
SCHEMBL4166243 0.90 PRMT1 (0.61) FUT8PRMT1CARM1ENPP2CD40
SCHEMBL13880626 0.88 FUT8 (0.50) FUT8PRMT1CARM1ENPP2CD40
SCHEMBL14565547 0.88 FUT8 (0.50) FUT8PRMT1CARM1ENPP2CD40
SCHEMBL14388936 0.86 PRMT1 (0.56) FUT8PRMT1CARM1ENPP2CD40
SCHEMBL13069419 0.86 FUT8 (0.53) FUT8PRMT1CARM1ENPP2MEN1
SCHEMBL11671754 0.86 THRB (0.50) PRMT1ENPP2CD40CD40LGMEN1
SCHEMBL11671747 0.86 THRB (0.50) PRMT1ENPP2CD40CD40LGMEN1
SCHEMBL14388852 0.86 PRMT1 (0.53) FUT8PRMT1CARM1ENPP2CD40
SCHEMBL14388947 0.84 PRMT1 (0.53) FUT8PRMT1CARM1ENPP2CD40

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-20070271711-A1 Dye Mixtures of Fibre-Reactive Azo Dyes Production and Use Thereof DYSTAR TEXTILFARBEN GMBH & CO., DEUTSCHLAND KG (DE) 2007-11-29 — — US disclosed
WO-2007039573-A2 AZO REACTIVE DYES AND MIXTURES OF FIBER-REACTIVE AZO DYES, THEIR PREPARATION AND THEIR USE DYSTAR TEXTILFARBEN GMBH & CO DEUTSCHLAND KG (DE) 2007-04-12 — — WO disclosed
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