SCHEMBL6022997

SCHEMBL6022997

COCCN1CCN(C(=O)c2ccc(C)c(C(=O)c3ccc(Nc4ccc(F)cc4C)cc3Cl)c2)CC1

nearest known ligand 0.54

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 6/20 0.54
MAPK13 O15264 5/20 0.54
MAPK12 P53778 5/20 0.54
MAPK11 Q15759 5/20 0.54
NAMPT P43490 2/20 0.42
RORC P51449 2/20 0.38
PKM P14618 1/20 0.38
EGFR P00533 1/20 0.38
LDHA P00338 1/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
KCNA5 P22460 2/20 0.37
DRD3 P35462 1/20 0.37
DRD2 P14416 1/20 0.37

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
SCHEMBL2198570 0.88 MAPK14 (0.62) MAPK14MAPK13MAPK12MAPK11
SCHEMBL2200850 0.84 MAPK14 (0.61) MAPK14MAPK13MAPK12MAPK11PKM
SCHEMBL2197033 0.81 MAPK14 (0.62) MAPK14MAPK13MAPK12MAPK11
SCHEMBL27655256 0.81 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11
SCHEMBL2197834 0.80 ALDH1A1 (0.44) NAMPTRORCNPC1RAB9AKCNA5
SCHEMBL2200568 0.79 MAPK14 (0.63) MAPK14MAPK13MAPK12MAPK11PKM
SCHEMBL2198787 0.78 MAPK14 (0.53) MAPK14MAPK13MAPK12MAPK11NAMPT
SCHEMBL27633942 0.77 MAPK14 (0.49) MAPK14MAPK13MAPK12MAPK11PKM
SCHEMBL2199941 0.76 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11NPC1
SCHEMBL2198608 0.76 MAPK14 (0.64) MAPK14MAPK13MAPK12MAPK11

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2006528597-A 2006-12-21 JP 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-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 697/4885MAPK13 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.