Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CNR2 | P34972 | 2/20 | 0.33 |
| ▸ | BTN3A1 | O00481 | 2/20 | 0.32 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.31 |
| ▸ | ADH1B | P00325 | 1/20 | 0.30 |
| ▸ | ADH1C | P00326 | 1/20 | 0.30 |
| ▸ | ADH1A | P07327 | 1/20 | 0.30 |
| ▸ | ADH4 | P08319 | 1/20 | 0.30 |
| ▸ | ADH7 | P40394 | 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 | |
|---|---|---|---|---|
| SCHEMBL9409633 | 1.00 | CNR2 (0.33) | CNR2BTN3A1CYP1A2ALOX5ADH1B | |
| SCHEMBL9762854 | 0.89 | — | — | |
| SCHEMBL9762850 | 0.89 | — | — | |
| SCHEMBL12440151 | 0.81 | CNR2 (0.33) | CNR2BTN3A1 | |
| SCHEMBL23924479 | 0.79 | CYP1A2 (0.36) | CYP1A2ALOX5ADH1BADH1CADH1A | |
| SCHEMBL18995744 | 0.79 | CNR2 (0.32) | CNR2BTN3A1 | |
| SCHEMBL5471525 | 0.77 | CYP1A2 (0.34) | CYP1A2ALOX5ADH1BADH1CADH1A | |
| SCHEMBL27832626 | 0.77 | ALOX5 (0.32) | CYP1A2ALOX5ADH1BADH1CADH1A | |
| SCHEMBL31538843 | 0.74 | EPHX1 (0.35) | CYP1A2ALOX5ADH1BADH1CADH1A | |
| SCHEMBL2439872 | 0.72 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5346885-A | ADDING A POLYCYCLIC KETONIC COMPOUND TO CONFER, IMPROVE, ENHANCE OR MODIFY THE ODOR PROPERTIES OF A PERFUME | FIRMENICH S.A. (CH) | 1994-09-13 | — | — | US | disclosed |
| EP-0580068-A2 | New polycyclic compounds and their use as perfuming ingredients | FIRMENICH SA (CH) | 1994-01-26 | — | — | EP | disclosed |
| US-5004843-A | Reacting A Vinyl Epoxide With An Organolithium Compound | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1991-04-02 | — | — | US | disclosed |
| EP-0029603-B1 | PROCESS FOR PREPARING PREDOMINANTLY Z-SUBSTITUTED ALLYLIC ALCOHOLS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1984-06-13 | — | — | EP | disclosed |