SCHEMBL14613192

SCHEMBL14613192

Cc1ccc(Nc2nc(Cl)nc(Nc3ccc(/N=N/c4ccc(S(=O)(=O)CCO[SH](=O)=O)cc4S(=O)(=O)O)c(N)c3)n2)cc1S(=O)(=O)O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.39
▸ CHAT P28329 3/20 0.37
▸ USP2 O75604 2/20 0.37
▸ APEX1 P27695 2/20 0.37
▸ CA9 Q16790 12/20 0.36
▸ CA12 O43570 11/20 0.36
▸ CA1 P00915 11/20 0.36
▸ CA2 P00918 11/20 0.36
▸ CA14 Q9ULX7 6/20 0.35
▸ ENPP3 O14638 1/20 0.35
▸ ENPP1 P22413 1/20 0.35
▸ HPGDS O60760 1/20 0.34
▸ CA5A P35218 1/20 0.33
▸ CA5B Q9Y2D0 1/20 0.33
▸ MEN1 O00255 1/20 0.33
▸ LMNA P02545 1/20 0.33
▸ TP53 P04637 1/20 0.33
▸ POLB P06746 1/20 0.33
▸ CYP3A4 P08684 1/20 0.33
▸ GAA P10253 1/20 0.33

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
SCHEMBL14693200 0.91 CHAT (0.38) FUT8CHATUSP2APEX1CA9
SCHEMBL14693000 0.84 CA9 (0.42) FUT8CHATUSP2APEX1CA9
SCHEMBL14546956 0.78 FUT8 (0.41) FUT8CHATUSP2APEX1CA9
SCHEMBL12053158 0.76 FUT8 (0.38) FUT8CHATUSP2APEX1CA9
SCHEMBL14547014 0.75 FUT8 (0.42) FUT8CHATUSP2APEX1CA9
SCHEMBL14582555 0.74 FUT8 (0.41) FUT8CHATUSP2APEX1MEN1
SCHEMBL12053213 0.73 FUT8 (0.38) FUT8CHATUSP2APEX1CA9
SCHEMBL13341085 0.72 FUT8 (0.37) FUT8CHATUSP2APEX1CA9
SCHEMBL14546977 0.72 CHAT (0.43) FUT8CHATUSP2APEX1CA9
SCHEMBL21239133 0.72 CHAT (0.45) FUT8CHATUSP2APEX1CA9

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-20070033746-A1 Method for the reactive coloring of leather BASF AKTIENGESSELLSCHAFT (DE) 2007-02-15 — — US disclosed
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