SCHEMBL16170912

SCHEMBL16170912

Cc1ccccc1/N=N/c1c(N)c(/N=N/c2ccc(NCCCCCO)cc2)cc(S(=O)(=O)O)c1N

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ SENP2 Q9HC62 5/20 0.49
▸ SENP1 Q9P0U3 5/20 0.49
▸ SUMO2 P61956 4/20 0.49
▸ SUMO1 P63165 4/20 0.49
▸ SENP7 Q9BQF6 4/20 0.49
▸ SENP3 Q9H4L4 3/20 0.49
▸ ALDH1A1 P00352 3/20 0.44
▸ APP P05067 3/20 0.44
▸ MEN1 O00255 2/20 0.44
▸ MAPT P10636 2/20 0.44
▸ THRB P10828 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ SNCA P37840 2/20 0.44
▸ RECQL P46063 2/20 0.44
▸ BLM P54132 2/20 0.44
▸ KMT2A Q03164 2/20 0.44
▸ TDP1 Q9NUW8 2/20 0.44
▸ ALOX12 P18054 1/20 0.44
▸ ENPP2 Q13822 5/20 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
SCHEMBL16170913 0.87 SENP2 (0.46) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL16170766 0.82 SENP2 (0.54) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL16170802 0.82 SENP2 (0.46) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL16170800 0.81 SENP2 (0.53) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL16170801 0.81 SENP2 (0.47) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL16170797 0.80 SENP2 (0.51) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL16170738 0.78 SENP2 (0.67) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL15044690 0.77 MAPT (0.41) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL15044907 0.77 MAPT (0.41) SENP2SENP1SUMO2SUMO1SENP7
SCHEMBL16170806 0.76 ENPP2 (0.50) 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
Send feedback