SCHEMBL14388939

SCHEMBL14388939

Nc1c(/N=N/c2ccc(S(=O)(=O)CCOS(=O)(=O)O)cc2)c(S(=O)(=O)O)cc2cc(S(=O)(=O)O)c(/N=N/c3cc(Nc4nc(Cl)nc(Cl)n4)ccc3S(=O)(=O)O)c(O)c12

nearest known ligand 0.55

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 1/20 0.55
▸ FUT8 Q9BYC5 1/20 0.50
▸ PRMT1 Q99873 2/20 0.44
▸ CARM1 Q86X55 1/20 0.44
▸ ENPP2 Q13822 7/20 0.41
▸ CD40 P25942 1/20 0.36
▸ CD40LG P29965 1/20 0.36
▸ CYP1A2 P05177 1/20 0.36
▸ PHLPP2 Q6ZVD8 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ HTT P42858 1/20 0.35
▸ KMT2A Q03164 1/20 0.35
▸ CA2 P00918 1/20 0.34
▸ CA3 P07451 1/20 0.34
▸ USP2 O75604 1/20 0.34
▸ APEX1 P27695 1/20 0.34
▸ CHAT P28329 1/20 0.34

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
SCHEMBL16624649 0.93 FUT8 (0.52) THRBFUT8PRMT1CARM1ENPP2
SCHEMBL16664577 0.93 FUT8 (0.51) THRBFUT8PRMT1CARM1ENPP2
SCHEMBL14514299 0.92 FUT8 (0.54) THRBFUT8PRMT1CARM1ENPP2
SCHEMBL12053476 0.92 THRB (0.46) THRBFUT8PRMT1CARM1ENPP2
SCHEMBL14038414 0.91 THRB (0.46) THRBFUT8PRMT1CARM1ENPP2
SCHEMBL14388839 0.91 THRB (0.56) THRBFUT8PRMT1CARM1ENPP2
SCHEMBL12053489 0.90 THRB (0.46) THRBFUT8PRMT1CARM1ENPP2
SCHEMBL18801754 0.89 THRB (0.47) THRBFUT8PRMT1CARM1ENPP2
SCHEMBL16626832 0.89 FUT8 (0.55) THRBFUT8PRMT1CARM1ENPP2
SCHEMBL16624647 0.88 FUT8 (0.54) THRBFUT8PRMT1CARM1ENPP2

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 1 patent. 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
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