SCHEMBL7457060

SCHEMBL7457060

O=[N+]([O-])c1ccc(NOS(=O)(=O)c2ccccc2)c([N+](=O)[O-])c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ CRHBP P24387 2/20 0.50
▸ CRHR2 Q13324 2/20 0.50
▸ MAPT P10636 8/20 0.49
▸ HPGD P15428 3/20 0.47
▸ L3MBTL1 Q9Y468 2/20 0.47
▸ MEN1 O00255 6/20 0.47
▸ KMT2A Q03164 6/20 0.47
▸ CTDSP1 Q9GZU7 1/20 0.47
▸ MAPK1 P28482 6/20 0.45
▸ ALDH1A1 P00352 5/20 0.45
▸ CYP1A2 P05177 2/20 0.45
▸ CYP3A4 P08684 2/20 0.45
▸ CYP2C9 P11712 2/20 0.45
▸ HIF1A Q16665 2/20 0.45
▸ TDP1 Q9NUW8 2/20 0.45
▸ CYP2D6 P10635 1/20 0.45
▸ CYP2C19 P33261 1/20 0.45
▸ POLB P06746 1/20 0.45
▸ PKM P14618 2/20 0.44
▸ LMNA P02545 3/20 0.44

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
SCHEMBL11628683 0.84 ALDH1A1 (0.50) CRHBPCRHR2MAPTHPGDL3MBTL1
SCHEMBL27863288 0.77 CRHBP (0.55) CRHBPCRHR2MAPTHPGDL3MBTL1
SCHEMBL10458259 0.75 CRHBP (0.45) CRHBPCRHR2MAPTHPGDL3MBTL1
SCHEMBL6553212 0.73 MAPT (0.60) CRHBPCRHR2MAPTHPGDL3MBTL1
SCHEMBL293916 0.72 MAPT (0.72) CRHBPCRHR2MAPTHPGDL3MBTL1
SCHEMBL12443496 0.71 CRHBP (0.57) CRHBPCRHR2MAPTHPGDL3MBTL1
SCHEMBL31715811 0.70 MAPT (0.73) CRHBPCRHR2MAPTHPGDL3MBTL1
SCHEMBL14871770 0.70 MAPK1 (0.61) CRHBPCRHR2MAPTMEN1KMT2A
SCHEMBL11023586 0.70 MEN1 (0.50) CRHBPCRHR2MAPTL3MBTL1MEN1
SCHEMBL3272499 0.70 MAPT (0.73) CRHBPCRHR2MAPTHPGDL3MBTL1

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
EP-1100809-A4 RNA TARGETED 2'-MODIFIED OLIGONUCLEOTIDES THAT ARE CONFORMATIONALLY PREORGANIZED ISIS PHARMACEUTICALS INC (US) 2002-02-27 — — EP disclosed
EP-1100809-A1 RNA TARGETED 2'-MODIFIED OLIGONUCLEOTIDES THAT ARE CONFORMATIONALLY PREORGANIZED ISIS PHARMACEUTICALS, INC. (US) 2001-05-23 — — EP disclosed
WO-2000006590-A1 RNA TARGETED 2'-MODIFIED OLIGONUCLEOTIDES THAT ARE CONFORMATIONALLY PREORGANIZED ISIS PHARMACEUTICALS, INC. (US) 2000-02-10 — — WO disclosed
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