SCHEMBL6330239

SCHEMBL6330239

Cc1cccc(C)c1N1CC(Cc2ccccc2O)CCC1=O

nearest known ligand 0.40

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
POLB P06746 2/20 0.40
ALDH1A1 P00352 2/20 0.40
P2RX7 Q99572 4/20 0.37
KMT2A Q03164 2/20 0.37
MAPT P10636 2/20 0.34
TP53 P04637 1/20 0.34
GAA P10253 1/20 0.34
MAPK1 P28482 1/20 0.34
HSD17B10 Q99714 1/20 0.34
C5AR1 P21730 1/20 0.33
RECQL P46063 1/20 0.33
DRD2 P14416 1/20 0.33
DRD1 P21728 1/20 0.33
BRD4 O60885 1/20 0.33
MEN1 O00255 1/20 0.33
HTT P42858 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
SCHEMBL6329240 0.85 P2RX7 (0.38) P2RX7KMT2AC5AR1DRD2MEN1
SCHEMBL6329626 0.82 ALDH1A1 (0.44) ALDH1A1P2RX7KMT2AMAPTTP53
SCHEMBL6335308 0.80 L3MBTL1 (0.42) POLBALDH1A1
SCHEMBL6330907 0.79 TP53 (0.41) MAPTTP53C5AR1
SCHEMBL6328213 0.78 P2RX7 (0.35) ALDH1A1P2RX7KMT2AMAPTMEN1
SCHEMBL6330234 0.78 KDM4E (0.41) POLBALDH1A1KMT2AMAPTGAA
SCHEMBL6328210 0.78 P2RX7 (0.35) ALDH1A1P2RX7KMT2AMAPTMEN1
SCHEMBL6330114 0.78 P2RX7 (0.43) ALDH1A1P2RX7
SCHEMBL6330392 0.75 SMN1; SMN2 (0.36) ALDH1A1KMT2AMAPTTP53C5AR1
SCHEMBL6328000 0.73 RAB9A (0.38) KMT2AC5AR1MEN1

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 1872/4885ALDH1A1 2969/4885P2RX7 2638/4885

“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.