SCHEMBL6328573

SCHEMBL6328573

CN(C)CCNc1cc(Cl)c(N2CC(Cc3ccc(F)cc3F)CCC2=O)c(Cl)c1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
NMT2 O60551 1/20 0.41
NMT1 P30419 1/20 0.41
POLB P06746 1/20 0.37
P2RX7 Q99572 9/20 0.36
PGR P06401 1/20 0.35
ACHE P22303 2/20 0.34
HTR2A P28223 1/20 0.34
HTR2C P28335 1/20 0.34
SOS1 Q07889 1/20 0.33
NQO2 P16083 2/20 0.33
GPR6 P46095 1/20 0.33
NQO1 P15559 1/20 0.33

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
SCHEMBL6329084 0.95 NMT2 (0.37) NMT2NMT1POLBP2RX7PGR
SCHEMBL6335096 0.92 NMT2 (0.41) NMT2NMT1POLBP2RX7HTR2A
SCHEMBL6335068 0.91 P2RX7 (0.35) NMT2NMT1P2RX7PGRHTR2A
SCHEMBL6336608 0.90 EED (0.38) POLBPGRSOS1
SCHEMBL6326225 0.89 P2RX7 (0.38) NMT2NMT1P2RX7
SCHEMBL6331104 0.88 P2RX7 (0.37) P2RX7HTR2AHTR2CGPR6
SCHEMBL6330100 0.87 P2RX7 (0.39) NMT2NMT1P2RX7
SCHEMBL6326804 0.87 MAPK14 (0.42) NMT2NMT1POLBP2RX7
SCHEMBL6336004 0.87 P2RX7 (0.39) P2RX7PGRACHEHTR2AHTR2C
SCHEMBL6336907 0.86 P2RX7 (0.38) P2RX7HTR2AGPR6

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 NMT2 3432/4885NMT1 3387/4885POLB 1872/4885

“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.