SCHEMBL16557846

SCHEMBL16557846

Nc1c(N=Nc2ccc(Nc3nc(Cl)nc(Nc4cccc(S(=O)(=O)O)c4)n3)cc2)cc(S(=O)(=O)O)c2cccc(O)c12

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CHAT P28329 3/20 0.48
▸ ENPP3 O14638 1/20 0.48
▸ ENPP1 P22413 1/20 0.48
▸ FUT8 Q9BYC5 1/20 0.47
▸ MEN1 O00255 2/20 0.43
▸ THRB P10828 2/20 0.43
▸ KMT2A Q03164 2/20 0.43
▸ ALDH1A1 P00352 1/20 0.43
▸ APP P05067 1/20 0.43
▸ MAPT P10636 1/20 0.43
▸ HPGD P15428 1/20 0.43
▸ ALOX12 P18054 1/20 0.43
▸ SNCA P37840 1/20 0.43
▸ RECQL P46063 1/20 0.43
▸ BLM P54132 1/20 0.43
▸ TDP1 Q9NUW8 1/20 0.43
▸ CA12 O43570 3/20 0.42
▸ CA1 P00915 3/20 0.42
▸ CA2 P00918 3/20 0.42
▸ CA9 Q16790 3/20 0.42

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
SCHEMBL16557845 0.93 SENP2 (0.49) CHATENPP3ENPP1FUT8MEN1
SCHEMBL16560628 0.93 CHAT (0.51) CHATENPP3ENPP1FUT8MEN1
SCHEMBL16557844 0.92 MEN1 (0.47) CHATFUT8MEN1THRBKMT2A
SCHEMBL16557852 0.90 FUT8 (0.41) CHATENPP3ENPP1FUT8MEN1
SCHEMBL16560627 0.87 FUT8 (0.47) CHATENPP3ENPP1FUT8MEN1
SCHEMBL16557871 0.85 FUT8 (0.42) CHATFUT8MEN1THRBKMT2A
SCHEMBL16560625 0.85 FUT8 (0.44) CHATENPP3ENPP1FUT8MEN1
SCHEMBL16557868 0.85 SENP2 (0.49) FUT8MEN1THRBKMT2AALDH1A1
SCHEMBL16557864 0.84 FUT8 (0.52) CHATENPP3ENPP1FUT8CA12
SCHEMBL16557848 0.84 MEN1 (0.47) FUT8MEN1THRBKMT2AALDH1A1

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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