Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 4/20 | 0.38 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.36 |
| ▸ | LTA4H | P09960 | 2/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | MAPT | P10636 | 1/20 | 0.35 |
| ▸ | NR5A1 | Q13285 | 1/20 | 0.35 |
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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL6254887 | 0.94 | CYP3A4 (0.46) | CYP3A4SMN1; SMN2PPARANR1I2ALDH1A1 | |
| SCHEMBL23539171 | 0.87 | PPARA (0.47) | CYP3A4SMN1; SMN2PPARAALDH1A1RECQL | |
| SCHEMBL14524692 | 0.85 | SMN1; SMN2 (0.47) | CYP3A4SMN1; SMN2HDAC6PPARAALDH1A1 | |
| SCHEMBL11091498 | 0.82 | L3MBTL1 (0.46) | CYP3A4SMN1; SMN2PPARAL3MBTL1LTA4H | |
| SCHEMBL6259760 | 0.81 | SMN1; SMN2 (0.41) | CYP3A4SMN1; SMN2PPARAALDH1A1L3MBTL1 | |
| SCHEMBL11988222 | 0.80 | LTA4H (0.55) | CYP3A4SMN1; SMN2HDAC6LTA4HNR5A1 | |
| SCHEMBL12868339 | 0.78 | DRD2 (0.52) | PPARAL3MBTL1 | |
| SCHEMBL483910 | 0.78 | CA12 (0.48) | SMN1; SMN2PPARAALDH1A1L3MBTL1MAPT | |
| SCHEMBL27262669 | 0.77 | MCHR1 (0.36) | CYP3A4SMN1; SMN2HDAC6ALDH1A1MAPT | |
| SCHEMBL10202971 | 0.76 | CYP1A2 (0.50) | SMN1; SMN2ALDH1A1L3MBTL1LTA4H |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| 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 |
| WO-2002030863-A2 | ETHER COMPOUNDS AND COMPOSITIONS FOR CHOLESTEROL MANAGEMENT AND RELATED USES | ESPERION THERAPEUTICS, INC. (US) | 2002-04-18 | — | — | WO | claimed |