Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.43 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | PAOX | Q6QHF9 | 5/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | LMNA | P02545 | 2/20 | 0.36 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.36 |
| ▸ | CES1 | P23141 | 2/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | CES2 | O00748 | 1/20 | 0.31 |
| ▸ | FFAR3 | O14843 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL19235255 | 0.93 | PAOX (0.50) | TDP1ALDH1A1PAOXACHECES1 | |
| SCHEMBL4036564 | 0.93 | PAOX (0.50) | TDP1ALDH1A1PAOXACHECES1 | |
| SCHEMBL10858203 | 0.84 | — | — | |
| SCHEMBL25668342 | 0.84 | — | — | |
| SCHEMBL25922913 | 0.81 | CES2 (0.48) | TDP1ALDH1A1PAOXCES1HSD17B10 | |
| SCHEMBL20828877 | 0.80 | SOAT1 (0.39) | TDP1ALDH1A1LMNACES1CES2 | |
| SCHEMBL10502566 | 0.80 | ALDH1A1 (0.43) | TDP1ALDH1A1PAOXACHELMNA | |
| SCHEMBL10502559 | 0.80 | ALDH1A1 (0.43) | TDP1ALDH1A1PAOXACHELMNA | |
| SCHEMBL11388784 | 0.78 | ALDH1A1 (0.41) | TDP1ALDH1A1PAOXACHELMNA | |
| SCHEMBL988309 | 0.78 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2017098048-A1 | PROCESS FOR THE MANUFACTURE OF 6,10,14-TRIMETHYLPENTADECAN-2-ONE | DSM IP ASSETS B.V. (NL) | 2017-06-15 | — | — | WO | disclosed |