SCHEMBL7729280

SCHEMBL7729280

O=[N+]([O-])[O-].O=[N+]([O-])[O-].[Cu+2].[Cu+2]

nearest known ligand 0.75

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 1/20 0.75
KMT2A Q03164 1/20 0.75
CA5A P35218 1/20 0.50
CA5B Q9Y2D0 1/20 0.50
ALDH1A1 P00352 4/20 0.42
TSHR P16473 3/20 0.42
TDP1 Q9NUW8 2/20 0.42
HPGD P15428 1/20 0.39
HIF1A Q16665 1/20 0.39

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
SCHEMBL29745875 1.00
SCHEMBL119829 1.00 MEN1 (0.75) MEN1KMT2ACA5ACA5BALDH1A1
SCHEMBL27742455 1.00 MEN1 (0.75) MEN1KMT2ACA5ACA5BALDH1A1
SCHEMBL22666 1.00
SCHEMBL7049290 0.94 MEN1 (0.67) MEN1KMT2ACA5ACA5BALDH1A1
SCHEMBL3796047 0.94 MEN1 (0.67) MEN1KMT2ACA5ACA5BALDH1A1
SCHEMBL10425715 0.94 MEN1 (0.67) MEN1KMT2ACA5ACA5BALDH1A1
Water SCHEMBL970907 0.94 MEN1 (0.67) MEN1KMT2ACA5ACA5BALDH1A1
SCHEMBL9844525 0.94 MEN1 (0.67) MEN1KMT2ACA5ACA5BALDH1A1
SCHEMBL1256652 0.94 MEN1 (0.67) MEN1KMT2ACA5ACA5BALDH1A1

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-2002016026-A2 ADSORBENT AND/OR CATALYST COMPOUNDS PROMOTED WITH HALIDE IONS AND METHODS OF MAKING AND USING THEREOF APYRON TECHNOLOGIES, INC. (US) 2002-02-28 WO disclosed