SCHEMBL15044756

SCHEMBL15044756

COC(=O)c1ccccc1/N=N/c1cc(S(=O)(=O)O)c(N)c(/N=N/c2ccc(S(=O)(=O)CCO)cc2)c1N

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.43
▸ THRB P10828 3/20 0.43
▸ ALDH1A1 P00352 2/20 0.43
▸ MEN1 O00255 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ TDP1 Q9NUW8 2/20 0.43
▸ APP P05067 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ SNCA P37840 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ CA2 P00918 2/20 0.42
▸ NPSR1 Q6W5P4 1/20 0.42
▸ SLC7A11 Q9UPY5 3/20 0.41
▸ GAA P10253 2/20 0.41
▸ GFER P55789 1/20 0.41
▸ ENPP2 Q13822 2/20 0.41
▸ SENP2 Q9HC62 4/20 0.40
▸ SENP1 Q9P0U3 4/20 0.40

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
SCHEMBL15044755 1.00 MAPT (0.43) MAPTTHRBALDH1A1MEN1KMT2A
SCHEMBL15044718 0.93 ENPP2 (0.41) MAPTTHRBALDH1A1MEN1KMT2A
SCHEMBL15044723 0.93 ENPP2 (0.41) MAPTTHRBALDH1A1MEN1KMT2A
SCHEMBL15044695 0.91 MAPT (0.41) MAPTTHRBALDH1A1MEN1KMT2A
SCHEMBL15044706 0.91 MAPT (0.41) MAPTTHRBALDH1A1MEN1KMT2A
SCHEMBL15044922 0.89 CA2 (0.41) MAPTTHRBALDH1A1MEN1KMT2A
SCHEMBL16170885 0.89 ENPP2 (0.41) MAPTTHRBALDH1A1MEN1KMT2A
SCHEMBL16173869 0.89 CA2 (0.41) MAPTTHRBALDH1A1MEN1KMT2A
SCHEMBL16173874 0.89 CA2 (0.41) MAPTTHRBALDH1A1MEN1KMT2A
SCHEMBL16170785 0.89 CA2 (0.41) MAPTTHRBALDH1A1MEN1KMT2A

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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