SCHEMBL2199137

SCHEMBL2199137

Cc1cc(F)ccc1Nc1ccc(C(=O)c2cc(OCC(O)CO)ccc2C)c(N)c1

nearest known ligand 0.49

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 20/20 0.49
MAPK11 Q15759 4/20 0.47
MAPK13 O15264 3/20 0.47
MAPK12 P53778 3/20 0.47
HSPB1 P04792 1/20 0.47
HTR2A P28223 1/20 0.47
HTR2B P41595 1/20 0.47
TMEM97 Q5BJF2 1/20 0.47
GAK O14976 1/20 0.39
LCK P06239 1/20 0.39
CYP3A4 P08684 1/20 0.39
PDGFRB P09619 1/20 0.39
CYP2D6 P10635 1/20 0.39
CYP2C9 P11712 1/20 0.39
MAPK9 P45984 1/20 0.39
MAPK10 P53779 1/20 0.39
EPHA5 P54756 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
SCHEMBL2199709 0.94 MAPK14 (0.57) MAPK14MAPK11MAPK13MAPK12HSPB1
SCHEMBL2199456 0.86 MAPK14 (0.47) MAPK14MAPK11MAPK13MAPK12HSPB1
SCHEMBL2198084 0.86 MAPK14 (0.49) MAPK14MAPK11MAPK13MAPK12
SCHEMBL2198289 0.80 MAPK14 (0.54) MAPK14MAPK11MAPK13MAPK12HSPB1
SCHEMBL2202850 0.80 MAPK14 (0.55) MAPK14MAPK11MAPK13MAPK12
SCHEMBL2196902 0.78 MAPK14 (0.60) MAPK14
SCHEMBL2199484 0.76 MAPK14 (0.49) MAPK14MAPK11MAPK13MAPK12HSPB1
SCHEMBL2198731 0.74 MAPK14 (0.60) MAPK14MAPK11MAPK13MAPK12HSPB1
SCHEMBL2198034 0.72 MAPK14 (0.46) MAPK14MAPK11MAPK13MAPK12
SCHEMBL2200292 0.72 MAPK14 (0.60) MAPK14HTR2A

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 14 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
JP-2006528597-A 2006-12-21 JP 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
EP-1658263-A1 NOVEL AMINOBENZOPHENONE COMPOUNDS Leo Pharma A/S (DK) 2006-05-24 EP claimed
WO-2005009940-A1 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA A/S (DK) 2005-02-03 WO 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
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
EP-1658263-A1 NOVEL AMINOBENZOPHENONE COMPOUNDS Leo Pharma A/S (DK) 2006-05-24 EP disclosed
WO-2005009940-A1 NOVEL AMINOBENZOPHENONE COMPOUNDS LEO PHARMA A/S (DK) 2005-02-03 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-20060166990-A1 Novel aminobenzophenone compounds NFKBIA, UACA, ALDH7A1 MAPK14 697/4885MAPK11 612/4885MAPK13 1063/4885

“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.