SCHEMBL6330907

SCHEMBL6330907

Cc1cccc(C)c1N1CC(Cc2ccccc2OCC(C)C)CCC1=O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TP53 P04637 1/20 0.41
MAPT P10636 1/20 0.41
SMN1; SMN2 Q16637 1/20 0.41
CACNA1G O43497 4/20 0.36
CACNA1H O95180 4/20 0.36
CACNA1I Q9P0X4 4/20 0.36
C5AR1 P21730 10/20 0.35
HCRTR1 O43613 1/20 0.34
HCRTR2 O43614 1/20 0.34
PIM1 P11309 1/20 0.33
KCNH2 Q12809 1/20 0.33
PIM2 Q9P1W9 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
SCHEMBL6330392 0.85 SMN1; SMN2 (0.36) TP53MAPTSMN1; SMN2C5AR1HCRTR1
SCHEMBL6335308 0.84 L3MBTL1 (0.42) SMN1; SMN2
SCHEMBL6330234 0.82 KDM4E (0.41) MAPTSMN1; SMN2
SCHEMBL6329240 0.79 P2RX7 (0.38) C5AR1
SCHEMBL6330239 0.79 POLB (0.40) TP53MAPTC5AR1
SCHEMBL6329626 0.76 ALDH1A1 (0.44) TP53MAPT
SCHEMBL6330593 0.74 CYP2D6 (0.43) HCRTR1HCRTR2
SCHEMBL6330114 0.74 P2RX7 (0.43)
SCHEMBL6328572 0.73 GAA (0.40) MAPT
SCHEMBL6328210 0.72 P2RX7 (0.35) MAPT

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 TP53 1063/4885MAPT 185/4885SMN1; SMN2 48/4885

“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.