⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
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 | |
|---|---|---|---|---|
| SCHEMBL11650882 | 0.97 | DNM1 (0.55) | — | |
| SCHEMBL22930958 | 0.97 | DNM1 (0.55) | — | |
| SCHEMBL11649530 | 0.97 | DNM1 (0.55) | — | |
| SCHEMBL15338308 | 0.97 | DNM1 (0.55) | — | |
| SCHEMBL16539899 | 0.92 | — | — | |
| SCHEMBL10447586 | 0.79 | — | — | |
| SCHEMBL15226429 | 0.78 | DNM1 (0.57) | — | |
| SCHEMBL16618988 | 0.74 | DNM1 (0.46) | — | |
| SCHEMBL27859387 | 0.74 | DNM1 (0.52) | — | |
| SCHEMBL7596055 | 0.74 | DNM1 (0.46) | — |
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-2022125856-A1 | AROMATIC ENOL ETHERS | EASTMAN CHEMICAL COMPANY (US) | 2022-06-16 | — | — | WO | disclosed |
| EP-0341602-A2 | Renin-inhibiting functionalized peptidyl aminodiols and - triols | ABBOTT LABORATORIES (US) | 1989-11-15 | — | — | EP | disclosed |