Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CES2 | O00748 | 4/20 | 0.39 |
| ▸ | FDPS | P14324 | 10/20 | 0.36 |
| ▸ | GGPS1 | O95749 | 7/20 | 0.36 |
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 | |
|---|---|---|---|---|
| Hexane SCHEMBL6279172 | 0.89 | CES2 (0.43) | CES2FDPSGGPS1 | |
| Hexane SCHEMBL3032232 | 0.89 | CES2 (0.43) | CES2FDPSGGPS1 | |
| Hexane SCHEMBL8467539 | 0.89 | CES2 (0.43) | CES2FDPSGGPS1 | |
| Hexane SCHEMBL10364795 | 0.89 | CES2 (0.43) | CES2FDPSGGPS1 | |
| Heptane SCHEMBL7356779 | 0.87 | CES2 (0.47) | CES2FDPSGGPS1 | |
| Pentane SCHEMBL16758664 | 0.85 | CES2 (0.39) | CES2FDPS | |
| SCHEMBL3627985 | 0.82 | TDP1 (0.47) | — | |
| Hexane SCHEMBL16758670 | 0.80 | CES2 (0.45) | CES2 | |
| Heptane SCHEMBL3805263 | 0.80 | CES2 (0.45) | CES2 | |
| Hexane SCHEMBL15967387 | 0.80 | CES2 (0.45) | CES2 |
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 |