SCHEMBL6326895

SCHEMBL6326895

CC(=O)Nc1ccc(Cl)c(N2CC(Cc3ccc(F)cc3F)CCC2=O)c1

nearest known ligand 0.41

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
ALDH1A1 P00352 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
P2RX7 Q99572 13/20 0.39
HTR2A P28223 1/20 0.39
CCR3 P51677 1/20 0.39
ATAD2 Q6PL18 1/20 0.36
CECR2 Q9BXF3 1/20 0.36

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
SCHEMBL6326197 0.88 RORC (0.43)
SCHEMBL6333754 0.87 P2RX7 (0.41) POLBL3MBTL1P2RX7HTR2ACCR3
SCHEMBL6326138 0.86 HTR2A (0.38) P2RX7HTR2A
SCHEMBL6326076 0.86 P2RX7 (0.36) P2RX7HTR2ACCR3
SCHEMBL6330372 0.84 TDP1 (0.37) POLBALDH1A1P2RX7
SCHEMBL6326075 0.83 HTR2A (0.38) P2RX7HTR2A
SCHEMBL6326051 0.81 RORC (0.42)
SCHEMBL6336600 0.79 P2RX7 (0.40) P2RX7HTR2ACCR3
SCHEMBL6330799 0.78 P2RX7 (0.39) P2RX7HTR2ACCR3
SCHEMBL6335084 0.78 NPY2R (0.40) P2RX7HTR2A

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 POLB 1872/4885L3MBTL1 2754/4885ALDH1A1 2969/4885

“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.