SCHEMBL16170804

SCHEMBL16170804

Cc1cccc(/N=N/c2c(N)c(/N=N/c3ccc(CCCO)cc3)cc(S(=O)(=O)O)c2N)c1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 2/20 0.46
▸ MEN1 O00255 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ APP P05067 2/20 0.44
▸ ALDH1A1 P00352 1/20 0.44
▸ MAPT P10636 1/20 0.44
▸ THRB P10828 1/20 0.44
▸ HPGD P15428 1/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ SNCA P37840 1/20 0.44
▸ RECQL P46063 1/20 0.44
▸ BLM P54132 1/20 0.44
▸ TDP1 Q9NUW8 1/20 0.44
▸ SENP2 Q9HC62 4/20 0.43
▸ SENP1 Q9P0U3 4/20 0.43
▸ SUMO2 P61956 3/20 0.43
▸ SUMO1 P63165 3/20 0.43
▸ SENP7 Q9BQF6 3/20 0.43
▸ SENP3 Q9H4L4 2/20 0.42
▸ SLC7A11 Q9UPY5 3/20 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
SCHEMBL16170718 0.85 PHLPP2 (0.45) PHLPP2MEN1KMT2AAPPALDH1A1
SCHEMBL16170797 0.84 SENP2 (0.51) PHLPP2MEN1KMT2AAPPALDH1A1
SCHEMBL16170810 0.83 ENPP2 (0.46) PHLPP2MEN1KMT2AAPPALDH1A1
SCHEMBL16170716 0.81 PHLPP2 (0.51) PHLPP2MEN1KMT2AAPPALDH1A1
SCHEMBL16170719 0.79 PHLPP2 (0.42) PHLPP2MEN1KMT2AAPPALDH1A1
SCHEMBL16170767 0.78 PHLPP2 (0.41) PHLPP2MEN1KMT2AAPPALDH1A1
SCHEMBL16170884 0.78 MAPT (0.41) PHLPP2MEN1KMT2AAPPALDH1A1
SCHEMBL16170768 0.77 PHLPP2 (0.44) PHLPP2MEN1KMT2AAPPALDH1A1
SCHEMBL16170765 0.77 PHLPP2 (0.55) PHLPP2MEN1KMT2AAPPALDH1A1
SCHEMBL16170721 0.77 PHLPP2 (0.45) PHLPP2MEN1KMT2AAPPALDH1A1

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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