SCHEMBL16170914

SCHEMBL16170914

COc1ccc(C)cc1/N=N/c1cc(S(=O)(=O)O)c(N)c(/N=N/c2cc(C)ccc2C)c1N

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ PHLPP2 Q6ZVD8 2/20 0.46
▸ SENP2 Q9HC62 4/20 0.45
▸ SENP1 Q9P0U3 4/20 0.45
▸ SUMO2 P61956 3/20 0.45
▸ SUMO1 P63165 3/20 0.45
▸ SENP7 Q9BQF6 3/20 0.45
▸ SENP3 Q9H4L4 3/20 0.45
▸ ALDH1A1 P00352 5/20 0.43
▸ MEN1 O00255 4/20 0.43
▸ MAPT P10636 4/20 0.43
▸ KMT2A Q03164 4/20 0.43
▸ TP53 P04637 3/20 0.43
▸ THRB P10828 3/20 0.43
▸ HPGD P15428 3/20 0.43
▸ RECQL P46063 3/20 0.43
▸ BLM P54132 3/20 0.43
▸ KDM4E B2RXH2 3/20 0.43
▸ CYP3A4 P08684 3/20 0.43
▸ ALOX15 P16050 2/20 0.43
▸ MAPK1 P28482 2/20 0.43

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
SCHEMBL15044700 0.95 PHLPP2 (0.47) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16170792 0.83 SENP2 (0.56) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16170716 0.82 PHLPP2 (0.51) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL12028012 0.81 ENPP2 (0.50) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL15044760 0.80 PHLPP2 (0.48) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16173908 0.80 PHLPP2 (0.48) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16170915 0.79 SENP2 (0.46) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16170719 0.78 PHLPP2 (0.42) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16170807 0.78 PHLPP2 (0.45) PHLPP2SENP2SENP1SUMO2SUMO1
SCHEMBL16170798 0.78 SENP2 (0.48) PHLPP2SENP2SENP1SUMO2SUMO1

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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