SCHEMBL2199173

SCHEMBL2199173

CC1(C)OCC(COc2ccc(F)c(C(=O)c3ccc(Nc4ccccc4[N+](=O)[O-])cc3Cl)c2)O1

nearest known ligand 0.53

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 18/20 0.53
MAPK13 O15264 2/20 0.53
MAPK12 P53778 2/20 0.53
MAPK11 Q15759 2/20 0.53
EPAS1 Q99814 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
SCHEMBL2201607 0.85 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11
SCHEMBL2201715 0.85 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11
SCHEMBL2198021 0.84 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11
SCHEMBL2199691 0.79 MAPK14 (0.60) MAPK14
SCHEMBL2198632 0.78 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11
SCHEMBL2196890 0.77 MAPK14 (0.56) MAPK14MAPK13MAPK12MAPK11EPAS1
SCHEMBL2199907 0.77 MAPK14 (0.51) MAPK14MAPK13MAPK12MAPK11
SCHEMBL2201141 0.75 MAPK13 (0.67) MAPK14MAPK13MAPK12MAPK11EPAS1
SCHEMBL7196619 0.75 MAPK13 (0.76) MAPK14MAPK13MAPK12MAPK11EPAS1
SCHEMBL6650756 0.74 MAPK13 (0.71) MAPK14MAPK13MAPK12MAPK11EPAS1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1826310-B Novel aminobenzophenone compounds LEO PHARMA AS 2010-07-21 CN claimed
CN-1826310-A Novel aminobenzophenone compounds LEO PHARMA AS (DK) 2006-08-30 CN claimed
US-20060166990-A1 Novel aminobenzophenone compounds LEO PHARMA A/S (DK) 2006-07-27 US claimed
US-7977387-B2 Aminobenzophenone compounds LEO PHARMA A/S (DK) 2011-07-12 US disclosed
US-7977387-B2 Aminobenzophenone compounds LEO PHARMA A/S (DK) 2011-07-12 US disclosed
CN-1826310-B Novel aminobenzophenone compounds LEO PHARMA AS 2010-07-21 CN disclosed
CN-1826310-A Novel aminobenzophenone compounds LEO PHARMA AS (DK) 2006-08-30 CN 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 MAPK14 697/4885MAPK13 1063/4885MAPK12 955/4885

“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.