Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | PAOX | Q6QHF9 | 3/20 | 0.38 |
| ▸ | ACHE | P22303 | 1/20 | 0.38 |
| ▸ | CES1 | P23141 | 5/20 | 0.34 |
| ▸ | CES2 | O00748 | 6/20 | 0.33 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | SLC15A2 | Q16348 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | GAA | P10253 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 1/20 | 0.31 |
| ▸ | AKR1B1 | P15121 | 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.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL1785307 | 0.82 | ALDH1A1 (0.41) | ALDH1A1PAOXACHECES1CES2 | |
| SCHEMBL12707702 | 0.81 | ALDH1A1 (0.43) | ALDH1A1PAOXACHELMNASLC15A2 | |
| SCHEMBL16463400 | 0.79 | ALDH1A1 (0.36) | ALDH1A1PAOXACHECES1LMNA | |
| SCHEMBL8895484 | 0.76 | ALDH1A1 (0.44) | ALDH1A1PAOXACHECES1CES2 | |
| SCHEMBL1781286 | 0.75 | ALDH1A1 (0.47) | ALDH1A1PAOXACHELMNASLC15A2 | |
| Acetone SCHEMBL15388957 | 0.75 | CES1 (0.58) | ALDH1A1PAOXACHECES1CES2 | |
| SCHEMBL1782224 | 0.74 | ALDH1A1 (0.41) | ALDH1A1PAOXACHECES1CES2 | |
| SCHEMBL11236803 | 0.73 | ALDH1A1 (0.45) | ALDH1A1PAOXACHELMNASLC15A2 | |
| SCHEMBL11232780 | 0.73 | ALDH1A1 (0.39) | ALDH1A1PAOXACHELMNASLC15A2 | |
| Acetone SCHEMBL7641219 | 0.72 | CES2 (0.60) | ALDH1A1PAOXCES1CES2TDP1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0531715-B1 | Process for producing alcohols and ketones | SUMITOMO CHEMICAL CO (JP) | 1997-11-05 | — | — | EP | disclosed |
| US-5426237-A | Oxidation of straight, branched or cyclic alkanes and benzene derivatives in presence of transition metal catalyst and aldehyde | SUMITOMO CHEMICAL CO., LTD. (JP) | 1995-06-20 | — | — | US | disclosed |
| EP-0531715-A1 | Process for producing alcohols and ketones | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1993-03-17 | — | — | EP | disclosed |