SCHEMBL2552295

SCHEMBL2552295

COCCNc1ccc(S(=O)(=O)N2CCOCC2)cc1[N+](=O)[O-]

nearest known ligand 0.82

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 10/20 0.82
TDP1 Q9NUW8 4/20 0.67
MAPT P10636 7/20 0.61
SMN1; SMN2 Q16637 6/20 0.61
L3MBTL1 Q9Y468 5/20 0.61
MAPK1 P28482 5/20 0.61
ALDH1A1 P00352 5/20 0.60
HPGD P15428 1/20 0.60
PKM P14618 2/20 0.59
GAA P10253 4/20 0.57
KDM4E B2RXH2 1/20 0.56
KMT2A Q03164 1/20 0.55

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
SCHEMBL9225175 0.85 LMNA (0.67) LMNATDP1MAPTSMN1; SMN2L3MBTL1
SCHEMBL14576206 0.79 KMT2A (0.62) LMNATDP1MAPTSMN1; SMN2L3MBTL1
SCHEMBL30468041 0.78 MAPT (0.70) LMNATDP1MAPTSMN1; SMN2ALDH1A1
SCHEMBL1700307 0.78 MAPT (0.70) LMNATDP1MAPTSMN1; SMN2ALDH1A1
SCHEMBL17841231 0.77 LMNA (0.76) LMNAMAPTMAPK1ALDH1A1GAA
SCHEMBL29483590 0.77 LMNA (0.76) LMNAMAPTMAPK1ALDH1A1GAA
SCHEMBL29483577 0.77 LMNA (0.76) LMNAMAPTMAPK1ALDH1A1GAA
SCHEMBL3994858 0.76 LMNA (0.65) LMNAMAPTSMN1; SMN2MAPK1ALDH1A1
SCHEMBL2716434 0.75 LMNA (0.70) LMNATDP1MAPTL3MBTL1MAPK1
SCHEMBL2546137 0.75 MAPT (0.64) LMNAMAPTSMN1; SMN2L3MBTL1ALDH1A1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2552208-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS Glaxo Group Limited (GB) 2013-02-06 EP disclosed
US-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-17 US disclosed
US-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-17 US disclosed
US-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2013-01-17 US disclosed
WO-2011123609-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2011-10-06 WO disclosed
WO-2011123609-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS GLAXO GROUP LIMITED (GB) 2011-10-06 WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20130018039-A1 IMIDAZOLYL-IMIDAZOLES AS KINASE INHIBITORS MAP3K19, MAP3K20, MAP3K3 LMNA 2804/4885TDP1 1322/4885MAPT 2704/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.