SCHEMBL15044936

SCHEMBL15044936

COC(=O)c1ccccc1/N=N/c1c(N)c(/N=N/c2cc(S(C)(=O)=O)ccc2O)cc(S(=O)(=O)O)c1N

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 6/20 0.44
▸ NPSR1 Q6W5P4 1/20 0.44
▸ ALDH1A1 P00352 2/20 0.43
▸ GAA P10253 2/20 0.43
▸ GFER P55789 1/20 0.43
▸ THRB P10828 2/20 0.42
▸ ENPP2 Q13822 2/20 0.40
▸ PHLPP2 Q6ZVD8 1/20 0.39
▸ MPL P40238 1/20 0.39
▸ SENP2 Q9HC62 4/20 0.39
▸ SENP1 Q9P0U3 4/20 0.39
▸ SUMO2 P61956 3/20 0.39
▸ SUMO1 P63165 3/20 0.39
▸ SENP7 Q9BQF6 3/20 0.39
▸ SENP3 Q9H4L4 3/20 0.39
▸ CA1 P00915 1/20 0.37
▸ CA2 P00918 1/20 0.37
▸ CA5A P35218 1/20 0.37
▸ CA9 Q16790 1/20 0.37
▸ MEN1 O00255 2/20 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
SCHEMBL15044934 1.00 MAPT (0.44) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL16170947 0.89 MPL (0.52) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL15044773 0.85 MAPT (0.51) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL15044771 0.85 MAPT (0.51) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL16170848 0.83 SENP2 (0.57) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL15044924 0.82 ENPP2 (0.42) MAPTALDH1A1GAAGFERTHRB
SCHEMBL15044933 0.82 ENPP2 (0.42) MAPTALDH1A1GAAGFERTHRB
SCHEMBL15044774 0.82 MAPT (0.47) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL15044932 0.82 MAPT (0.47) MAPTNPSR1ALDH1A1GAAGFER
SCHEMBL16170948 0.80 SENP2 (0.41) MAPTALDH1A1THRBENPP2PHLPP2

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 5 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-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
US-20140304926-A1 Azo Dyes HUNTSMAN INTERNATIONAL LLC 2014-10-16 — — US disclosed
WO-2013087400-A2 AZO DYES HUNTSMAN ADVANCED MATERIALS (SWITZERLAND) GMBH (CH) 2013-06-20 — — WO disclosed
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