SCHEMBL16557850

SCHEMBL16557850

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

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ THRB P10828 3/20 0.41
▸ SLC7A11 Q9UPY5 3/20 0.39
▸ MEN1 O00255 2/20 0.39
▸ KMT2A Q03164 2/20 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
▸ TDP1 Q9NUW8 1/20 0.39
▸ SENP2 Q9HC62 3/20 0.38
▸ SENP1 Q9P0U3 3/20 0.38
▸ SUMO2 P61956 2/20 0.38
▸ SUMO1 P63165 2/20 0.38
▸ SENP7 Q9BQF6 2/20 0.38
▸ CYP1A2 P05177 1/20 0.37
▸ ATIC P31939 1/20 0.36

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
SCHEMBL16557871 0.93 FUT8 (0.42) THRBSLC7A11MEN1KMT2AALDH1A1
SCHEMBL16557852 0.88 FUT8 (0.41) THRBSLC7A11MEN1KMT2AALDH1A1
SCHEMBL16557848 0.88 MEN1 (0.47) THRBSLC7A11MEN1KMT2AALDH1A1
SCHEMBL16557868 0.87 SENP2 (0.49) THRBSLC7A11MEN1KMT2AALDH1A1
SCHEMBL16560626 0.86 FUT8 (0.42) THRBMEN1KMT2AMAPTHPGD
SCHEMBL16557866 0.86 THRB (0.50) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL16560669 0.81 CHAT (0.42) THRBMEN1KMT2ACA12CA1
SCHEMBL16557843 0.81 THRB (0.45) THRBSENP2SUMO2SUMO1SENP7
SCHEMBL14388839 0.80 THRB (0.56) THRBMEN1KMT2ACYP1A2CA2
SCHEMBL16560633 0.80 MEN1 (0.43) THRBSLC7A11MEN1KMT2AALDH1A1

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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