SCHEMBL13454515

SCHEMBL13454515

Nc1nc(Cl)nc(Nc2ccc(N=Nc3ccc4c(S(=O)(=O)O)cccc4c3S(=O)(=O)O)c3cccc(S(=O)(=O)O)c23)n1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MEN1 O00255 3/20 0.45
▸ KMT2A Q03164 3/20 0.45
▸ THRB P10828 2/20 0.45
▸ CYP1A2 P05177 1/20 0.40
▸ FUT8 Q9BYC5 1/20 0.38
▸ ATIC P31939 3/20 0.38
▸ CHAT P28329 4/20 0.37
▸ SNCA P37840 2/20 0.37
▸ HPGDS O60760 1/20 0.36
▸ NSD2 O96028 1/20 0.36
▸ POLB P06746 1/20 0.36
▸ IDE P14735 1/20 0.36
▸ DUSP3 P51452 1/20 0.36
▸ CCR6 P51684 1/20 0.36
▸ BLM P54132 1/20 0.36
▸ NR4A1 P22736 1/20 0.36
▸ CTRB1 P17538 1/20 0.35
▸ SUMO2 P61956 1/20 0.35
▸ SUMO1 P63165 1/20 0.35
▸ SENP7 Q9BQF6 1/20 0.35

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
SCHEMBL13454500 0.88 SENP2 (0.50) MEN1KMT2ATHRBCYP1A2FUT8
SCHEMBL12189769 0.84 MEN1 (0.51) MEN1KMT2ATHRBCYP1A2FUT8
SCHEMBL12172932 0.84 MEN1 (0.54) MEN1KMT2ATHRBCYP1A2FUT8
SCHEMBL13539076 0.84 MEN1 (0.52) MEN1KMT2ATHRBCYP1A2FUT8
SCHEMBL20314641 0.83 MEN1 (0.47) MEN1KMT2ATHRBCYP1A2FUT8
SCHEMBL13454483 0.82 MEN1 (0.40) MEN1KMT2ATHRBCYP1A2ATIC
SCHEMBL13454514 0.81 MEN1 (0.41) MEN1KMT2ATHRBCYP1A2ATIC
SCHEMBL13469025 0.81 MEN1 (0.39) MEN1KMT2ATHRBCYP1A2ATIC
SCHEMBL18216954 0.81 FUT8 (0.38) MEN1KMT2ATHRBCYP1A2FUT8
SCHEMBL13454507 0.79 SENP2 (0.51) MEN1KMT2ATHRBCYP1A2FUT8

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 5 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
US-20120264922-A1 REACTIVE DYE EVERLIGHT USA, INC. (US) 2012-10-18 — — US disclosed
EP-2511347-A1 Reactive dye Everlight USA, Inc. (US) 2012-10-17 — — EP disclosed
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