SCHEMBL17934592

SCHEMBL17934592

COC(=O)c1ccc(Nc2ccc([N+](=O)[O-])c3nonc23)c(C(=O)NCc2cccc(B(C)O)c2)c1

nearest known ligand 0.69

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ MYC P01106 14/20 0.69
▸ MAX P61244 8/20 0.53
▸ MEN1 O00255 7/20 0.46
▸ KMT2A Q03164 7/20 0.46
▸ IDO1 P14902 1/20 0.42
▸ POLB P06746 1/20 0.42
▸ GAA P10253 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42
▸ USP2 O75604 1/20 0.42
▸ HTT P42858 1/20 0.42
▸ RECQL P46063 1/20 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
SCHEMBL17934577 0.89 MYC (0.63) MYCMAXMEN1KMT2AIDO1
SCHEMBL17934594 0.86 MYC (0.71) MYCMAXMEN1KMT2AIDO1
SCHEMBL17927359 0.82 MYC (1.00) MYCMAXMEN1KMT2AIDO1
SCHEMBL17927400 0.79 MYC (0.75) MYCMAXMEN1KMT2AIDO1
SCHEMBL17934017 0.76 MYC (0.72) MYCMAXMEN1KMT2AIDO1
SCHEMBL26266093 0.75 MYC (0.75) MYCMAXMEN1KMT2AIDO1
SCHEMBL17934468 0.74 MYC (0.76) MYCMAXMEN1KMT2AIDO1
SCHEMBL17927384 0.74 MYC (0.82) MYCMAXMEN1KMT2AIDO1
SCHEMBL17934016 0.74 MYC (0.75) MYCMAXMEN1KMT2AIDO1
SCHEMBL17927410 0.73 MYC (0.73) MYCMAXMEN1KMT2AIDO1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2016115360-A1 C-MYC LIGANDS CAPABLE OF DIMERIZING IN AN AQUEOUS SOLUTION, AND METHODS OF USING SAME COFERON, INC. (US) 2016-07-21 — — WO disclosed
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