SCHEMBL6329615

SCHEMBL6329615

O=C1CCC(Cc2ccc(F)cc2F)CN1c1c(Cl)cc(CO)cc1Cl

nearest known ligand 0.37

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
P2RX7 Q99572 15/20 0.37
HTR2A P28223 3/20 0.37
HTR2C P28335 3/20 0.37
BCHE P06276 1/20 0.34
ACHE P22303 1/20 0.34
BACE1 P56817 1/20 0.34
PGR P06401 1/20 0.34

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
SCHEMBL6329598 0.88 HTR2A (0.39) P2RX7HTR2AHTR2CBCHEACHE
SCHEMBL6328298 0.87 HTR2A (0.39) P2RX7HTR2AHTR2CPGR
SCHEMBL6335030 0.87 HTR2A (0.44) P2RX7HTR2AHTR2CBCHEACHE
SCHEMBL6337245 0.87 HTR2A (0.44) P2RX7HTR2AHTR2CBCHEACHE
SCHEMBL6327592 0.87 HTR2A (0.44) P2RX7HTR2AHTR2CBCHEACHE
SCHEMBL6337759 0.87 PGR (0.38) P2RX7HTR2AHTR2CPGR
SCHEMBL6328483 0.87 HTR2A (0.38) P2RX7HTR2AHTR2CBCHEACHE
SCHEMBL6406268 0.87 P2RX7 (0.39) P2RX7HTR2AHTR2C
Hydrochloric Acid SCHEMBL6326691 0.86 HTR2A (0.37) P2RX7HTR2AHTR2CBCHEACHE
SCHEMBL6331104 0.86 P2RX7 (0.37) P2RX7HTR2AHTR2C

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 P2RX7 2638/4885HTR2A 2694/4885HTR2C 3759/4885

“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.