⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19083175 | 0.83 | CYP2D6 (0.32) | — | |
| SCHEMBL22318088 | 0.82 | — | — | |
| SCHEMBL10111451 | 0.82 | SMN1; SMN2 (0.37) | — | |
| SCHEMBL22317788 | 0.81 | — | — | |
| SCHEMBL26137689 | 0.79 | ALDH1A1 (0.30) | — | |
| SCHEMBL18559500 | 0.77 | TSHR (0.32) | — | |
| SCHEMBL22966960 | 0.77 | ALDH1A1 (0.32) | — | |
| SCHEMBL15259312 | 0.77 | — | — | |
| SCHEMBL21339483 | 0.76 | TSHR (0.33) | — | |
| SCHEMBL19823684 | 0.75 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2020160193-A2 | COMPOUNDS AND USES THEREOF | FOGHORN THERAPEUTICS INC. (US) | 2020-08-06 | — | — | WO | disclosed |