Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TRPA1 | O75762 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 3/20 | 0.31 |
| ▸ | CNR1 | P21554 | 1/20 | 0.31 |
| ▸ | CNR2 | P34972 | 1/20 | 0.31 |
| ▸ | KLK7 | P49862 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5200741 | 0.76 | TSHR (0.40) | ALDH1A1 | |
| SCHEMBL28558437 | 0.74 | LMNA (0.38) | — | |
| SCHEMBL28565430 | 0.74 | LMNA (0.38) | — | |
| SCHEMBL9298460 | 0.73 | TRPA1 (0.48) | TRPA1ALDH1A1L3MBTL1CYP2C19FAAH | |
| SCHEMBL1848801 | 0.73 | TRPA1 (0.48) | TRPA1ALDH1A1L3MBTL1CYP2C19FAAH | |
| SCHEMBL4438144 | 0.72 | TRPA1 (0.46) | TRPA1ALDH1A1L3MBTL1CYP2C19FAAH | |
| SCHEMBL9471232 | 0.71 | — | — | |
| SCHEMBL8382940 | 0.71 | — | — | |
| SCHEMBL8382943 | 0.71 | — | — | |
| SCHEMBL11804451 | 0.71 | — | — |
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-4882429-A | Stereospecific preparation of (3S,4R,5R)-3-(1-hydroxyethyl)-4-benzoyloxy-azeridinones from L-(-)-theonine | SCHERING CORPORATION (US) | 1989-11-21 | — | — | US | disclosed |
| EP-0240164-A2 | Preparation of azetidinones | SCHERING CORPORATION (US) | 1987-10-07 | — | — | EP | disclosed |