SCHEMBL14495373

SCHEMBL14495373

O=S(=O)(O)OCCS(=O)(=O)c1ccc(Nc2nc(Cl)nc(Nc3cc(S(=O)(=O)O)cc4cc(SO)c(/N=N/c5ccccc5S(=O)(=O)O)c(O)c34)n2)cc1

nearest known ligand 0.69

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.69
▸ THRB P10828 2/20 0.37
▸ MEN1 O00255 1/20 0.37
▸ KMT2A Q03164 1/20 0.37
▸ ENPP2 Q13822 2/20 0.36
▸ CHAT P28329 4/20 0.36
▸ USP2 O75604 1/20 0.36
▸ APEX1 P27695 1/20 0.36
▸ CYP1A2 P05177 3/20 0.35
▸ CYP2C9 P11712 1/20 0.35
▸ MAPK1 P28482 1/20 0.35
▸ DNASE1L3 Q13609 1/20 0.35
▸ PRMT1 Q99873 2/20 0.33
▸ ENPP3 O14638 1/20 0.33
▸ ENPP1 P22413 1/20 0.33
▸ CARM1 Q86X55 1/20 0.32
▸ CA12 O43570 4/20 0.32
▸ CA1 P00915 4/20 0.32
▸ CA2 P00918 4/20 0.32
▸ CA9 Q16790 4/20 0.32

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
SCHEMBL12173038 0.93 FUT8 (0.81) FUT8THRBMEN1KMT2AENPP2
SCHEMBL13599534 0.87 FUT8 (0.60) FUT8THRBMEN1KMT2AENPP2
SCHEMBL12173026 0.86 FUT8 (0.74) FUT8THRBMEN1KMT2AENPP2
SCHEMBL18135177 0.85 FUT8 (0.68) FUT8THRBMEN1KMT2AENPP2
SCHEMBL16624669 0.85 FUT8 (0.73) FUT8THRBMEN1KMT2AENPP2
SCHEMBL13880699 0.85 FUT8 (0.68) FUT8THRBMEN1KMT2AENPP2
SCHEMBL29886741 0.85 FUT8 (0.68) FUT8THRBMEN1KMT2AENPP2
SCHEMBL13998607 0.85 FUT8 (0.54) FUT8THRBMEN1KMT2AENPP2
SCHEMBL13538879 0.84 FUT8 (0.53) FUT8THRBMEN1KMT2AENPP2
SCHEMBL14500860 0.83 FUT8 (0.74) FUT8THRBMEN1KMT2AENPP2

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
WO-2007063024-A2 KERATIN-BINDING EFFECTOR MOLECULES CONTAINING REACTIVE DYES BASF SE (DE) 2007-06-07 — — WO disclosed
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