Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.50 |
| ▸ | FAAH | O00519 | 6/20 | 0.46 |
| ▸ | ZDHHC7 | Q9NXF8 | 1/20 | 0.44 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | GPR84 | Q9NQS5 | 6/20 | 0.43 |
| ▸ | LMNA | P02545 | 2/20 | 0.43 |
| ▸ | CNR1 | P21554 | 1/20 | 0.41 |
| ▸ | CNR2 | P34972 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL29248331 | 1.00 | ACE2 (0.50) | ACE2FAAHZDHHC7MAPTGPR84 | |
| SCHEMBL15756260 | 1.00 | ACE2 (0.50) | ACE2FAAHZDHHC7MAPTGPR84 | |
| SCHEMBL28288920 | 1.00 | ACE2 (0.50) | ACE2FAAHZDHHC7MAPTGPR84 | |
| SCHEMBL6523473 | 1.00 | ACE2 (0.50) | ACE2FAAHZDHHC7MAPTGPR84 | |
| SCHEMBL12446351 | 1.00 | ACE2 (0.50) | ACE2FAAHZDHHC7MAPTGPR84 | |
| SCHEMBL28426484 | 1.00 | ACE2 (0.50) | ACE2FAAHZDHHC7MAPTGPR84 | |
| SCHEMBL10048635 | 0.98 | ACE2 (0.47) | ACE2FAAHZDHHC7MAPTGPR84 | |
| Isobutane SCHEMBL29126862 | 0.96 | ACE2 (0.46) | ACE2FAAHZDHHC7MAPTGPR84 | |
| Hydrochloric Acid SCHEMBL30110404 | 0.96 | ACE2 (0.46) | ACE2FAAHZDHHC7MAPTGPR84 | |
| SCHEMBL29991139 | 0.94 | FAAH (0.49) | ACE2FAAHZDHHC7LMNA |
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-0024517-B1 | 3-METHYL ALDEHYDES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ODORANTS | HAARMANN & REIMER GMBH (DE) | 1982-06-09 | — | — | EP | disclosed |
| US-4263459-A | 3-Methyl-aldehydes, processes for their preparation and their use as odorants | HAARMANN & REIMER GMBH (DE) | 1981-04-21 | — | — | US | disclosed |
| EP-0024517-A1 | 3-Methyl aldehydes, process for their preparation and their use as odorants | HAARMANN & REIMER GMBH (DE) | 1981-03-11 | — | — | EP | disclosed |