Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 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 | |
|---|---|---|---|---|
| Ether SCHEMBL17291816 | 0.71 | — | — | |
| Ether SCHEMBL6618296 | 0.71 | — | — | |
| Ether SCHEMBL6 | 0.71 | — | — | |
| Ether SCHEMBL9248674 | 0.71 | ALDH1A1 (0.47) | ALDH1A1 | |
| Ether SCHEMBL8160191 | 0.71 | ALDH1A1 (0.47) | ALDH1A1 | |
| SCHEMBL1042486 | 0.71 | — | — | |
| Ether SCHEMBL9248046 | 0.71 | ALDH1A1 (0.47) | ALDH1A1 | |
| Ether SCHEMBL21406 | 0.71 | ALDH1A1 (0.47) | ALDH1A1 | |
| Benzene SCHEMBL665216 | 0.68 | ALDH1A1 (0.39) | ALDH1A1 | |
| Benzene SCHEMBL9989943 | 0.68 | ALDH1A1 (0.39) | ALDH1A1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5648354-A | 1,2-dithiins having antifungal activity | SHAMAN PHARMACEUTICALS, INC. (US) | 1997-07-15 | — | — | US | disclosed |
| WO-1995024404-A1 | PREPARATION OF SYMMETRICAL AND UNSYMMETRICAL DITHIIN COMPOUNDS | SHAMAN PHARMACEUTICALS, INC. (US) | 1995-09-14 | — | — | WO | disclosed |