SCHEMBL16557871

SCHEMBL16557871

Nc1c(N=Nc2ccc(Nc3nc(Cl)nc(Nc4ccc(S(=O)(=O)CCOS(=O)(=O)O)cc4)n3)cc2)cc(S(=O)(=O)O)c2cccc(O)c12

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ FUT8 Q9BYC5 1/20 0.42
▸ SLC7A11 Q9UPY5 3/20 0.39
▸ THRB P10828 2/20 0.39
▸ MEN1 O00255 1/20 0.39
▸ ALDH1A1 P00352 1/20 0.39
▸ APP P05067 1/20 0.39
▸ MAPT P10636 1/20 0.39
▸ HPGD P15428 1/20 0.39
▸ ALOX12 P18054 1/20 0.39
▸ SNCA P37840 1/20 0.39
▸ RECQL P46063 1/20 0.39
▸ BLM P54132 1/20 0.39
▸ KMT2A Q03164 1/20 0.39
▸ TDP1 Q9NUW8 1/20 0.39
▸ SENP2 Q9HC62 2/20 0.38
▸ SENP1 Q9P0U3 2/20 0.38
▸ SUMO2 P61956 1/20 0.38
▸ SUMO1 P63165 1/20 0.38
▸ SENP7 Q9BQF6 1/20 0.38
▸ CHAT P28329 2/20 0.37

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
SCHEMBL16557852 0.95 FUT8 (0.41) FUT8SLC7A11THRBMEN1ALDH1A1
SCHEMBL16560626 0.93 FUT8 (0.42) FUT8THRBMEN1MAPTHPGD
SCHEMBL16557850 0.93 THRB (0.41) FUT8SLC7A11THRBMEN1ALDH1A1
SCHEMBL16560669 0.88 CHAT (0.42) FUT8THRBMEN1KMT2ACHAT
SCHEMBL16557844 0.88 MEN1 (0.47) FUT8SLC7A11THRBMEN1ALDH1A1
SCHEMBL16557845 0.87 SENP2 (0.49) FUT8SLC7A11THRBMEN1ALDH1A1
SCHEMBL16557841 0.86 THRB (0.48) FUT8THRBCHATUSP2APEX1
SCHEMBL16557846 0.85 CHAT (0.48) FUT8SLC7A11THRBMEN1ALDH1A1
SCHEMBL12053387 0.83 CHAT (0.42) FUT8SLC7A11THRBMEN1ALDH1A1
SCHEMBL16557869 0.81 FUT8 (0.44) FUT8THRBCHATUSP2APEX1

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-9394445-B2 Method for continuously preparing water-soluble azo dye by coupling a nebulizer with a pipeline DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2016-07-19 — — US disclosed
US-20150073132-A1 METHOD FOR CONTINUOUSLY PREPARING WATER-SOLUBLE AZO DYE BY COUPLING A NEBULIZER WITH A PIPELINE DALIAN UNIVERSITY OF TECHNOLOGY (CN) 2015-03-12 — — US disclosed
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