SCHEMBL16170712

SCHEMBL16170712

COC(=O)c1ccccc1/N=N/c1cc(S(=O)(=O)O)c(N)c(/N=N/c2cc(C)c(S(=O)(=O)CCO)cc2CO)c1N

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SENP2 Q9HC62 5/20 0.41
▸ SENP1 Q9P0U3 5/20 0.41
▸ SUMO2 P61956 4/20 0.41
▸ SUMO1 P63165 4/20 0.41
▸ SENP7 Q9BQF6 4/20 0.41
▸ SENP3 Q9H4L4 3/20 0.41
▸ 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
▸ ENPP2 Q13822 1/20 0.39
▸ CA2 P00918 3/20 0.38
▸ THRB P10828 2/20 0.38
▸ PHLPP2 Q6ZVD8 1/20 0.36
▸ MEN1 O00255 1/20 0.35
▸ APP P05067 1/20 0.35
▸ HPGD P15428 1/20 0.35
▸ ALOX12 P18054 1/20 0.35
▸ SNCA P37840 1/20 0.35

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
SCHEMBL16170784 0.91 MAPT (0.39) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL16173871 0.90 MAPT (0.39) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL15044906 0.90 MAPT (0.39) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL15044920 0.89 MAPT (0.38) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL16170885 0.88 ENPP2 (0.41) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL16170785 0.88 CA2 (0.41) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL15044759 0.83 MAPT (0.41) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL16173873 0.83 MAPT (0.41) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL15044755 0.83 MAPT (0.43) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL15044756 0.83 MAPT (0.43) SENP2SENP1SUMO2SUMO1SENP7

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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