SCHEMBL16173871

SCHEMBL16173871

COC(=O)c1ccccc1/N=N/c1cc(S(=O)(=O)O)c(N)c(/N=N/c2cc(C)c(S(=O)(=O)CCO)cc2OC)c1N

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.39
▸ NPSR1 Q6W5P4 1/20 0.39
▸ ALDH1A1 P00352 2/20 0.39
▸ GAA P10253 1/20 0.39
▸ GFER P55789 1/20 0.39
▸ SENP2 Q9HC62 3/20 0.39
▸ SENP1 Q9P0U3 3/20 0.39
▸ SUMO2 P61956 2/20 0.39
▸ SUMO1 P63165 2/20 0.39
▸ SENP7 Q9BQF6 2/20 0.39
▸ SENP3 Q9H4L4 2/20 0.39
▸ THRB P10828 2/20 0.38
▸ CA2 P00918 1/20 0.38
▸ ENPP2 Q13822 5/20 0.37
▸ PTPN1 P18031 2/20 0.36
▸ TP53 P04637 2/20 0.36
▸ KDM4E B2RXH2 1/20 0.36
▸ MEN1 O00255 1/20 0.36
▸ CYP3A4 P08684 1/20 0.36
▸ HPGD P15428 1/20 0.36

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
SCHEMBL15044906 1.00 MAPT (0.39) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL15044759 0.93 MAPT (0.41) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL16173873 0.93 MAPT (0.41) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL16170712 0.90 SENP2 (0.41) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL16170713 0.90 SENP2 (0.49) MAPTALDH1A1SENP2SENP1SUMO2
SCHEMBL15044920 0.89 MAPT (0.38) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL15044707 0.89 PTPN1 (0.41) MAPTALDH1A1SENP2SENP1SUMO2
SCHEMBL16173874 0.88 CA2 (0.41) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL15044902 0.88 CA2 (0.41) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL15044922 0.88 CA2 (0.41) MAPTNPSR1ALDH1A1GAAGFER

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-8961621-B2 Azo dyes HUNTSMAN INTERNATIONAL LLC (US) 2015-02-24 — — US disclosed
US-20140304926-A1 Azo Dyes HUNTSMAN INTERNATIONAL LLC 2014-10-16 — — US disclosed
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