SCHEMBL6267147

SCHEMBL6267147

CC(C)(CCCCOCCCCC(C)(C)CCC(=O)O)CCC(=O)O

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FFAR1 O14842 1/20 0.47
CPT2 P23786 1/20 0.47
TDP1 Q9NUW8 1/20 0.47
TBXAS1 P24557 2/20 0.46
ALDH1A1 P00352 3/20 0.41
CYP4F2 P78329 2/20 0.37
CYP4A11 Q02928 2/20 0.37
TSHR P16473 3/20 0.37
NAALAD2 Q9Y3Q0 1/20 0.37
S1PR1 P21453 2/20 0.35
S1PR3 Q99500 2/20 0.35
S1PR4 O95977 1/20 0.35
MEN1 O00255 1/20 0.34
CYP1A2 P05177 1/20 0.34
THRB P10828 1/20 0.34
KMT2A Q03164 1/20 0.34
ESR1 P03372 1/20 0.34
CYP3A4 P08684 1/20 0.34
ESR2 Q92731 1/20 0.34
LMNA P02545 2/20 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
SCHEMBL3049303 0.93 CYP4F2 (0.44) FFAR1CPT2TDP1TBXAS1ALDH1A1
SCHEMBL3044269 0.93 CYP4F2 (0.44) FFAR1CPT2TDP1TBXAS1ALDH1A1
SCHEMBL3049340 0.91 FFAR1 (0.44) FFAR1CPT2TDP1TBXAS1ALDH1A1
SCHEMBL3031115 0.87 LPAR3 (0.42) FFAR1CPT2TDP1TBXAS1ALDH1A1
SCHEMBL28462384 0.86 ALDH1A1 (0.59) FFAR1CPT2TDP1TBXAS1ALDH1A1
SCHEMBL3044812 0.86 FFAR1 (0.40) FFAR1CPT2TDP1TBXAS1ALDH1A1
SCHEMBL3041305 0.86 TBXAS1 (0.38) FFAR1CPT2TDP1TBXAS1ALDH1A1
SCHEMBL3047320 0.86 TBXAS1 (0.38) FFAR1CPT2TDP1TBXAS1ALDH1A1
SCHEMBL3040864 0.86 LPAR3 (0.41) FFAR1CPT2TDP1TBXAS1ALDH1A1
SCHEMBL3041593 0.86 TBXAS1 (0.38) FFAR1CPT2TDP1TBXAS1ALDH1A1

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 2 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 disclosed
US-20040192771-A1 Ether compounds and compositions for cholesterol management and related uses ESPERION THERAPEUTICS, INC. 2004-09-30 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 (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-20040192771-A1 Ether compounds and compositions for cholesterol management and related uses GPR119, PNLIP, NR1H2 FFAR1 103/4885CPT2 71/4885TDP1 1887/4885

“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.