Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | TP53 | P04637 | 1/20 | 0.44 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.44 |
| ▸ | TSHR | P16473 | 1/20 | 0.44 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.44 |
| ▸ | HTT | P42858 | 1/20 | 0.41 |
| ▸ | LDHA | P00338 | 1/20 | 0.41 |
| ▸ | CTBP2 | P56545 | 1/20 | 0.40 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
| ▸ | F2RL1 | P55085 | 1/20 | 0.40 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | APLNR | P35414 | 1/20 | 0.39 |
| ▸ | TSPO | P30536 | 1/20 | 0.39 |
| ▸ | TGM2 | P21980 | 1/20 | 0.39 |
| ▸ | CTSK | P43235 | 1/20 | 0.39 |
| ▸ | BCL2A1 | Q16548 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL11043144 | 0.89 | SMN1; SMN2 (0.41) | SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15 | |
| SCHEMBL11039015 | 0.82 | L3MBTL1 (0.41) | SMN1; SMN2ALDH1A1CYP3A4HTTCTBP2 | |
| SCHEMBL11043536 | 0.81 | ALDH1A1 (0.46) | SMN1; SMN2ALDH1A1CYP3A4CTSK | |
| SCHEMBL11039805 | 0.79 | SMN1; SMN2 (0.46) | SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15 | |
| SCHEMBL8039407 | 0.73 | ALDH1A1 (0.50) | SMN1; SMN2ALDH1A1HTTLDHACTBP2 | |
| SCHEMBL24734363 | 0.73 | SMN1; SMN2 (0.49) | SMN1; SMN2HTTLDHAEPHX2F2RL1 | |
| SCHEMBL20269317 | 0.73 | SMN1; SMN2 (0.49) | SMN1; SMN2HTTLDHAEPHX2F2RL1 | |
| SCHEMBL9392395 | 0.71 | SMN1; SMN2 (0.47) | SMN1; SMN2HTTLDHACTBP2EPHX2 | |
| SCHEMBL16740537 | 0.71 | ALDH1A1 (0.47) | SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15 | |
| SCHEMBL10786742 | 0.71 | ALDH1A1 (0.55) | SMN1; SMN2ALDH1A1TP53CYP3A4ALOX15 |
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-0038471-B1 | BETA-GAMMA-UNSATURATED KETONES AND ISOPRENOIC DIENONES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS PERFUME COMPOUNDS AND FLAVOURINGS | Consortium für elektrochemische Industrie GmbH (DE) | 1984-11-14 | — | — | EP | disclosed |
| US-4385185-A | β-γ-Unsaturated ketones and isoprenoid 2,6 diones, a process for producing the same and their use as fragrant and flavoring substances | CONSORTIUM FUR ELEKTROCHEMISCHE INDUSTRIE GMBH (DE) | 1983-05-24 | — | — | US | disclosed |
| EP-0038471-A1 | Beta-gamma-unsaturated ketones and isoprenoic dienones, process for their preparation and their use as perfume compounds and flavourings | Consortium für elektrochemische Industrie GmbH (DE) | 1981-10-28 | — | — | EP | disclosed |