SCHEMBL6328593

SCHEMBL6328593

CN(C)CCCc1cc(Cl)c(N2CC(Cc3ccc(F)cc3F)CCC2=O)c(Cl)c1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
PGR P06401 1/20 0.38
ACHE P22303 3/20 0.38
HTR2A P28223 3/20 0.36
HTR2C P28335 3/20 0.36
P2RX7 Q99572 7/20 0.34
NMT2 O60551 1/20 0.33
NMT1 P30419 1/20 0.33
MPO P05164 1/20 0.33
SLC6A4 P31645 1/20 0.33
MAPK14 Q16539 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
SCHEMBL6326023 0.97 ACHE (0.37) PGRACHEHTR2AHTR2CP2RX7
SCHEMBL6337759 0.89 PGR (0.38) PGRHTR2AHTR2CP2RX7MAPK14
SCHEMBL6328483 0.89 HTR2A (0.38) PGRACHEHTR2AHTR2CP2RX7
Hydrochloric Acid SCHEMBL6326691 0.88 HTR2A (0.37) PGRACHEHTR2AHTR2CP2RX7
SCHEMBL6329084 0.88 NMT2 (0.37) PGRACHEHTR2AHTR2CP2RX7
SCHEMBL6328909 0.87 ACHE (0.36) PGRACHEHTR2AHTR2CP2RX7
SCHEMBL6331063 0.87 PGR (0.41) PGRHTR2AHTR2CP2RX7MAPK14
SCHEMBL6328573 0.85 NMT2 (0.41) PGRACHEHTR2AHTR2CP2RX7
SCHEMBL6327538 0.85 HTR2A (0.34) PGRHTR2AHTR2CP2RX7NMT2
SCHEMBL6329615 0.84 P2RX7 (0.37) PGRACHEHTR2AHTR2CP2RX7

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 PGR 597/4885ACHE 3730/4885HTR2A 2694/4885

“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.