SCHEMBL6330433

SCHEMBL6330433

COC(c1ccc(F)cc1F)C1CCC(=O)N(c2c(Cl)cccc2Cl)C1

nearest known ligand 0.36

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
MAPK14 Q16539 10/20 0.36
MAPK11 Q15759 2/20 0.34
MAPK13 O15264 1/20 0.34
MAPK12 P53778 1/20 0.34
P2RX7 Q99572 4/20 0.33
HCRTR2 O43614 1/20 0.33
OPRM1 P35372 1/20 0.33
NR3C2 P08235 2/20 0.32
KCNJ5 P48544 1/20 0.32
KCNJ3 P48549 1/20 0.32
KCNQ1 P51787 1/20 0.32
CACNA1C Q13936 1/20 0.32

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
SCHEMBL6333145 0.87 MAPK14 (0.34) MAPK14MAPK11MAPK13MAPK12
SCHEMBL6337204 0.86 MAPK14 (0.37) MAPK14MAPK11MAPK13MAPK12P2RX7
SCHEMBL6328812 0.85 MAPK14 (0.38) MAPK14MAPK11MAPK13MAPK12P2RX7
SCHEMBL6328151 0.84 MAPK14 (0.37) MAPK14MAPK11MAPK13MAPK12P2RX7
SCHEMBL6335578 0.75 MAPK14 (0.39) MAPK14MAPK11MAPK13MAPK12
SCHEMBL6330414 0.74 PDE2A (0.34) P2RX7OPRM1
SCHEMBL6335030 0.71 HTR2A (0.44) MAPK14P2RX7
SCHEMBL6333390 0.71 MEN1 (0.44) MAPK14MAPK11MAPK13MAPK12P2RX7
SCHEMBL6336800 0.71 GAA (0.40) MAPK14MAPK11MAPK13MAPK12P2RX7
SCHEMBL6327592 0.71 HTR2A (0.44) MAPK14P2RX7

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
US-20050085509-A1 Piperidin-2-one derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO. LTD. (JP) 2005-04-21 US claimed
EP-1447401-A1 PIPERIDIN-2-ONE DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-08-18 EP claimed
US-20050085509-A1 Piperidin-2-one derivative compounds and drugs containing these compounds as the active ingredient ONO PHARMACEUTICAL CO. LTD. (JP) 2005-04-21 US disclosed
EP-1447401-A1 PIPERIDIN-2-ONE DERIVATIVE COMPOUNDS AND DRUGS CONTAINING THESE COMPOUNDS AS THE ACTIVE INGREDIENT ONO PHARMACEUTICAL CO., LTD. (JP) 2004-08-18 EP 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-20050085509-A1 Piperidin-2-one derivative compounds and drugs containing these compounds as the active ingredient MAPKAP1, MAPK1, MAPK8 MAPK14 64/4885MAPK11 92/4885MAPK13 15/4885

“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.