SCHEMBL2199795

SCHEMBL2199795

COC(=O)c1ccc(C)c(C(=O)c2ccc(Nc3ccccc3[N+](=O)[O-])cc2Cl)c1

nearest known ligand 0.74

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MAPK13 O15264 11/20 0.74
MAPK12 P53778 11/20 0.74
MAPK11 Q15759 11/20 0.74
MAPK14 Q16539 11/20 0.74
LMNA P02545 4/20 0.49
AKR1C3 P42330 2/20 0.47
AKR1C2 P52895 2/20 0.47
AKR1C4 P17516 1/20 0.47
AKR1C1 Q04828 1/20 0.47
HTT P42858 2/20 0.46
MEN1 O00255 3/20 0.45
KMT2A Q03164 3/20 0.45
ALDH1A1 P00352 2/20 0.44
ATM Q13315 1/20 0.44
SMN1; SMN2 Q16637 1/20 0.44
MAPT P10636 1/20 0.44
XBP1 P17861 1/20 0.44
TDP1 Q9NUW8 1/20 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
SCHEMBL2199203 0.90 MAPK13 (0.77) MAPK13MAPK12MAPK11MAPK14AKR1C3
SCHEMBL2199762 0.88 MAPK13 (0.57) MAPK13MAPK12MAPK11MAPK14LMNA
SCHEMBL2200233 0.87 MAPK13 (0.66) MAPK13MAPK12MAPK11MAPK14LMNA
SCHEMBL6655015 0.86 MAPK14 (1.00) MAPK13MAPK12MAPK11MAPK14LMNA
SCHEMBL2197842 0.85 MAPK14 (0.79) MAPK13MAPK12MAPK11MAPK14LMNA
SCHEMBL2198908 0.84 MAPK13 (0.68) MAPK13MAPK12MAPK11MAPK14LMNA
SCHEMBL2199523 0.84 MAPK14 (0.72) MAPK13MAPK12MAPK11MAPK14ALDH1A1
SCHEMBL2195134 0.82 MAPK13 (0.70) MAPK13MAPK12MAPK11MAPK14LMNA
SCHEMBL6658543 0.82 MAPK13 (0.80) MAPK13MAPK12MAPK11MAPK14LMNA
SCHEMBL7193817 0.82 MAPK13 (0.73) MAPK13MAPK12MAPK11MAPK14LMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1658263-B9 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA AS (DK) 2011-11-09 EP disclosed
US-7977387-B2 Aminobenzophenone compounds LEO PHARMA A/S (DK) 2011-07-12 US disclosed
EP-1658263-B1 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA AS (DK) 2010-06-02 EP disclosed
US-20060166990-A1 Novel aminobenzophenone compounds LEO PHARMA A/S (DK) 2006-07-27 US 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-20060166990-A1 Novel aminobenzophenone compounds NFKBIA, UACA, ALDH7A1 MAPK13 1063/4885MAPK12 955/4885MAPK11 612/4885

“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.