Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 1/20 | 0.33 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | APLNR | P35414 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL14879850 | 0.73 | SMN1; SMN2 (0.37) | SMN1; SMN2POLB | |
| SCHEMBL16010886 | 0.70 | CHRNB2 (0.39) | SMN1; SMN2POLB | |
| SCHEMBL3533992 | 0.64 | — | — | |
| SCHEMBL15874145 | 0.62 | APLNR (0.39) | SMN1; SMN2POLBAPLNR | |
| SCHEMBL15116745 | 0.62 | — | — | |
| SCHEMBL14825419 | 0.62 | FFAR3 (0.35) | CYP3A4SMN1; SMN2APLNR | |
| SCHEMBL11293670 | 0.61 | CHRNB2 (0.39) | APLNR | |
| SCHEMBL3778963 | 0.61 | APLNR (0.48) | CYP3A4APLNR | |
| SCHEMBL17816947 | 0.60 | — | — | |
| Bicarbonate SCHEMBL11398445 | 0.60 | APLNR (0.40) | SMN1; SMN2APLNR |
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-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 |