Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AKR1C3 | P42330 | 4/20 | 0.46 |
| ▸ | AKR1C2 | P52895 | 4/20 | 0.46 |
| ▸ | S1PR1 | P21453 | 2/20 | 0.45 |
| ▸ | SRD5A2 | P31213 | 1/20 | 0.44 |
| ▸ | ADH5 | P11766 | 1/20 | 0.44 |
| ▸ | PDE3B | Q13370 | 3/20 | 0.42 |
| ▸ | PDE3A | Q14432 | 3/20 | 0.42 |
| ▸ | PLOD2 | O00469 | 1/20 | 0.41 |
| ▸ | KIF11 | P52732 | 1/20 | 0.40 |
| ▸ | BCL2L1 | Q07817 | 1/20 | 0.40 |
| ▸ | BAD | Q92934 | 1/20 | 0.40 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.39 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.39 |
| ▸ | ADCY8 | P40145 | 1/20 | 0.39 |
| ▸ | ADCY1 | Q08828 | 1/20 | 0.39 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
| ▸ | VNN1 | O95497 | 1/20 | 0.38 |
| ▸ | AKR1B10 | O60218 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL30991476 | 0.88 | AKR1C3 (0.50) | AKR1C3AKR1C2S1PR1SRD5A2ADH5 | |
| SCHEMBL30991468 | 0.86 | AKR1C3 (0.48) | AKR1C3AKR1C2S1PR1SRD5A2ADH5 | |
| SCHEMBL5430185 | 0.79 | TAS1R3 (0.47) | KIF11VNN1 | |
| SCHEMBL26919869 | 0.78 | SRD5A2 (0.47) | AKR1C3AKR1C2S1PR1SRD5A2ADH5 | |
| SCHEMBL26920142 | 0.78 | SRD5A2 (0.47) | AKR1C3AKR1C2S1PR1SRD5A2ADH5 | |
| SCHEMBL26919872 | 0.78 | SRD5A2 (0.47) | AKR1C3AKR1C2S1PR1SRD5A2ADH5 | |
| SCHEMBL30991461 | 0.76 | SRD5A2 (0.46) | AKR1C3AKR1C2S1PR1SRD5A2ADH5 | |
| SCHEMBL23302210 | 0.76 | ADH5 (0.63) | AKR1C3AKR1C2SRD5A2ADH5BCL2L1 | |
| SCHEMBL26946408 | 0.75 | S1PR1 (0.46) | AKR1C3AKR1C2S1PR1SRD5A2ADH5 | |
| SCHEMBL28098468 | 0.75 | MAPT (0.54) | AKR1C3AKR1C2S1PR1SRD5A2ADH5 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023237651-A1 | METHOD FOR THE PREPARATION OF A 3,6-DIHYDRO-2H-1,3,4-OXADIAZIN-2-ONE | BAYER AKTIENGESELLSCHAFT (DE) | 2023-12-14 | — | — | WO | disclosed |
| EP-4289828-A1 | METHOD FOR THE PREPARATION OF A 3,6-DIHYDRO-2H-1,3,4-OXADIAZIN-2-ONE | Bayer Aktiengesellschaft (DE) | 2023-12-13 | — | — | EP | disclosed |