SCHEMBL6258518

SCHEMBL6258518

COC(=O)C(C)(C)CCCOCCCOCCCC(C)(C)C(=O)OC

nearest known ligand 0.39

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
CYP4F2 P78329 2/20 0.39
CYP4A11 Q02928 2/20 0.39
DGAT1 O75907 1/20 0.34
PPARA Q07869 8/20 0.33
TSHR P16473 2/20 0.32
TTR P02766 1/20 0.32
CYP1A2 P05177 1/20 0.32
CYP2C8 P10632 1/20 0.32
CHRM1 P11229 1/20 0.32
CYP2C9 P11712 1/20 0.32
ADRA1A P35348 1/20 0.32
PPARG P37231 1/20 0.32
HTR2B P41595 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
SLCO1B3 Q9NPD5 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
CISD1 Q9NZ45 1/20 0.32
SLCO1B1 Q9Y6L6 1/20 0.32
ACLY P53396 1/20 0.31

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
SCHEMBL6256870 0.94 CYP4F2 (0.42) CYP4F2CYP4A11DGAT1TSHRACLY
SCHEMBL20375533 0.92 CYP4F2 (0.43) CYP4F2CYP4A11DGAT1PPARATSHR
SCHEMBL6286840 0.92 CYP4F2 (0.35) CYP4F2CYP4A11DGAT1TSHR
SCHEMBL5527551 0.90 CYP4F2 (0.46) CYP4F2CYP4A11DGAT1TSHRTDP1
SCHEMBL6899779 0.86 HRH3 (0.34) CYP4F2CYP4A11DGAT1
SCHEMBL13355267 0.85 CYP4F2 (0.40) CYP4F2CYP4A11DGAT1PPARATSHR
SCHEMBL22016456 0.85 ACLY (0.46) CYP4F2CYP4A11PPARATSHRTTR
SCHEMBL8057594 0.83 ACLY (0.49) CYP4F2CYP4A11PPARATSHRTTR
SCHEMBL27438732 0.83 ACLY (0.49) CYP4F2CYP4A11PPARATSHRTTR
SCHEMBL5529314 0.83 CYP4F2 (0.35) CYP4F2CYP4A11PPARATSHRTTR

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 7 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2005068410-A1 ETHER COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. (US) 2005-07-28 WO claimed
US-20040192771-A1 Ether compounds and compositions for cholesterol management and related uses ESPERION THERAPEUTICS, INC. 2004-09-30 US claimed
JP-2004529069-A 2004-09-24 JP claimed
EP-1351916-A2 ETHER COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES Esperion Therapeutics Inc. (US) 2003-10-15 EP claimed
US-20030018013-A1 Ether compounds and compositions for cholesterol management and related uses ESPERION THERAPEUTICS, INC. 2003-01-23 US claimed
WO-2002030863-A2 ETHER COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES ESPERION THERAPEUTICS, INC. (US) 2002-04-18 WO claimed
US-6713507-B2 CARDIOVASCULAR DISORDERS; ANTILIPEMIC AGENTS; ALZHEIMER'S DISEASE ESPERION THERAPEUTICS, INC. 2004-03-30 US 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 (2 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-20030018013-A1 Ether compounds and compositions for cholesterol management and related uses GPR119, PNLIP, NR1H2 CYP4F2 561/4885CYP4A11 51/4885DGAT1 60/4885
US-20040192771-A1 Ether compounds and compositions for cholesterol management and related uses GPR119, PNLIP, NR1H2 CYP4F2 561/4885CYP4A11 51/4885DGAT1 60/4885

“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.