SCHEMBL5862277

SCHEMBL5862277

COC(=O)/C=C/Cn1c(C)cc(OCc2ccc(F)cc2F)cc1=O

nearest known ligand 0.47

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GSK3B P49841 2/20 0.47
BACE1 P56817 2/20 0.47
MAOB P27338 1/20 0.45
MAPK14 Q16539 16/20 0.41
PTGER1 P34995 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
SCHEMBL4465621 0.90 MAOB (0.46) GSK3BBACE1MAOBMAPK14PTGER1
SCHEMBL4465611 0.90 MAOB (0.46) GSK3BBACE1MAOBMAPK14PTGER1
SCHEMBL4386822 0.82 MAOB (0.48) GSK3BBACE1MAOBMAPK14
SCHEMBL13603054 0.82 MAPK14 (0.61) MAPK14
SCHEMBL5862284 0.81 MAOB (0.48) GSK3BBACE1MAOBMAPK14PTGER1
SCHEMBL6526149 0.76 MAOB (0.53) GSK3BBACE1MAOBMAPK14
SCHEMBL4384621 0.76 MAOB (0.45) MAOBMAPK14
SCHEMBL4378569 0.75 MAPK14 (0.53) MAOBMAPK14
SCHEMBL4380109 0.74 MAPK14 (0.47) GSK3BBACE1MAOBMAPK14PTGER1
SCHEMBL13602834 0.73 MAPK14 (0.55) MAOBMAPK14PTGER1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7067540-B2 Substituted pyridinones PHARMACIA CORPORATION (US) 2006-06-27 US disclosed
US-20050176775-A1 Substituted pyridinones PHARMACIA CORPORATION 2005-08-11 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-20050176775-A1 Substituted pyridinones MAPK1, MAPK6, MAP3K6 GSK3B 1243/4885BACE1 3100/4885MAOB 560/4885

“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.