SCHEMBL13454518

SCHEMBL13454518

O=C(O)c1ccc[n+](-c2nc(Nc3cccc(S(=O)(=O)O)c3)nc(Nc3ccc(N=Nc4cc(S(=O)(=O)O)c5cccc(S(=O)(=O)O)c5c4)c4cccc(S(=O)(=O)O)c34)n2)c1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.48
▸ KMT2A Q03164 3/20 0.48
▸ THRB P10828 2/20 0.48
▸ ATIC P31939 3/20 0.37
▸ SENP2 Q9HC62 3/20 0.37
▸ SUMO2 P61956 2/20 0.37
▸ SUMO1 P63165 2/20 0.37
▸ SENP7 Q9BQF6 2/20 0.37
▸ CHAT P28329 3/20 0.34
▸ SNCA P37840 1/20 0.34
▸ ENPP3 O14638 1/20 0.33
▸ ENPP1 P22413 1/20 0.33
▸ FUT8 Q9BYC5 1/20 0.33
▸ RHOA P61586 1/20 0.33
▸ HPSE Q9Y251 3/20 0.32
▸ ENPP2 Q13822 1/20 0.32
▸ TTR P02766 1/20 0.32
▸ FABP4 P15090 1/20 0.32
▸ CCNA2 P20248 1/20 0.32
▸ CDK2 P24941 1/20 0.32

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
SCHEMBL13454484 0.90 MEN1 (0.47) MEN1KMT2ATHRBATICSENP2
SCHEMBL13454517 0.90 MEN1 (0.41) MEN1KMT2ATHRBATICSENP2
SCHEMBL13454502 0.89 SENP2 (0.42) MEN1KMT2ATHRBATICSENP2
SCHEMBL13454519 0.88 MEN1 (0.39) MEN1KMT2ATHRBATICSENP2
SCHEMBL13469033 0.84 SENP2 (0.40) MEN1KMT2ATHRBATICSENP2
SCHEMBL13454505 0.84 SENP2 (0.40) MEN1KMT2ATHRBATICSENP2
SCHEMBL13454512 0.82 SENP2 (0.43) MEN1KMT2ATHRBATICSENP2
SCHEMBL13454530 0.82 MEN1 (0.41) MEN1KMT2ATHRBHPSEENPP2
SCHEMBL13454486 0.81 SENP2 (0.44) MEN1KMT2ATHRBATICSENP2
SCHEMBL15255589 0.80 MEN1 (0.42) MEN1KMT2ATHRBFUT8HPSE

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8536329-B2 Reactive dye EVERLIGHT USA, INC. (US) 2013-09-17 — — US disclosed
US-8536329-B2 Reactive dye EVERLIGHT USA, INC. (US) 2013-09-17 — — US disclosed
US-20120264922-A1 REACTIVE DYE EVERLIGHT USA, INC. (US) 2012-10-18 — — US disclosed
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