Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CHRNB2 | P17787 | 1/20 | 0.32 |
| ▸ | CHRNA4 | P43681 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL11364049 | 0.57 | CHRNB2 (0.33) | CHRNB2CHRNA4 | |
| SCHEMBL11949184 | 0.56 | — | — | |
| SCHEMBL9839632 | 0.56 | ALOX15 (0.31) | ALOX15 | |
| SCHEMBL18415040 | 0.55 | CHRNB2 (0.35) | CHRNB2CHRNA4 | |
| SCHEMBL13776654 | 0.55 | — | — | |
| SCHEMBL11480809 | 0.55 | CHRNB2 (0.41) | ALDH1A1CYP3A4CHRNB2CHRNA4 | |
| SCHEMBL445095 | 0.54 | CHRNB2 (0.37) | CYP3A4CHRNB2CHRNA4 | |
| SCHEMBL2051779 | 0.54 | — | — | |
| SCHEMBL6907314 | 0.54 | — | — | |
| SCHEMBL10293946 | 0.53 | CHRNB2 (0.36) | CYP3A4CHRNB2CHRNA4 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0260585-B1 | BICYCLIC KETONES, METHOD FOR THEIR PRODUCTION AND AROMA AND/OR FLAVOUR COMPOSITIONS CONTAINING SAID KETONES | L. GIVAUDAN & CIE Société Anonyme (CH) | 1991-10-16 | — | — | EP | claimed |
| US-4877904-A | Bicyclic ketones as odorants and flavorants | GIVAUDAN CORPORATION (US) | 1989-10-31 | — | — | US | claimed |
| EP-0260585-A2 | Bicyclic ketones, method for their production and aroma and/or flavour compositions containing said ketones | L. GIVAUDAN & CIE Société Anonyme (CH) | 1988-03-23 | — | — | EP | claimed |
| EP-0260585-B1 | BICYCLIC KETONES, METHOD FOR THEIR PRODUCTION AND AROMA AND/OR FLAVOUR COMPOSITIONS CONTAINING SAID KETONES | L. GIVAUDAN & CIE Société Anonyme (CH) | 1991-10-16 | — | — | EP | disclosed |
| US-4877904-A | Bicyclic ketones as odorants and flavorants | GIVAUDAN CORPORATION (US) | 1989-10-31 | — | — | US | disclosed |
| EP-0260585-A2 | Bicyclic ketones, method for their production and aroma and/or flavour compositions containing said ketones | L. GIVAUDAN & CIE Société Anonyme (CH) | 1988-03-23 | — | — | EP | disclosed |