SCHEMBL6330935

SCHEMBL6330935

CC(C)OC(=O)CO[PH](=O)OCC(=O)OC(C)C

nearest known ligand 0.41

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.41
MAPT P10636 2/20 0.40
TSHR P16473 2/20 0.39
CYP2D6 P10635 1/20 0.33
ALDH1A1 P00352 1/20 0.33
HTT P42858 1/20 0.32
PPARG P37231 1/20 0.32
NCOA2 Q15596 1/20 0.32
NCOA1 Q15788 1/20 0.32
NPSR1 Q6W5P4 1/20 0.32
RXFP1 Q9HBX9 1/20 0.32
NCOA3 Q9Y6Q9 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
HCAR2 Q8TDS4 1/20 0.31
ESR1 P03372 1/20 0.30

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
SCHEMBL10613438 0.83 MMP1 (0.31)
SCHEMBL3895682 0.76
SCHEMBL11115364 0.75 LMNA (0.46) LMNAMAPTTSHRCYP2D6ALDH1A1
SCHEMBL28715252 0.74 TSHR (0.44) MAPTTSHRALDH1A1PPARGNCOA2
SCHEMBL271918 0.73
SCHEMBL1311829 0.73 LMNA (0.45) LMNAMAPTTSHRCYP2D6ALDH1A1
SCHEMBL2940797 0.73 TSHR (0.46) LMNAMAPTTSHRALDH1A1HTT
SCHEMBL7915885 0.72 PRKCA (0.40) LMNAMAPTALDH1A1
SCHEMBL10141967 0.71
SCHEMBL14851204 0.71

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
JP-56057824-A None JP disclosed
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
JP-S5657824-A PREPARATION OF POLYESTER NIPPON ESTER CO LTD 1981-05-20 JP 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 LMNA 913/4885MAPT 185/4885TSHR 1679/4885

“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.