⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2782178 | 0.77 | — | — | |
| SCHEMBL5948644 | 0.73 | FDPS (0.32) | — | |
| SCHEMBL197476 | 0.71 | — | — | |
| SCHEMBL6280783 | 0.71 | TSHR (0.33) | — | |
| SCHEMBL5682440 | 0.71 | — | — | |
| SCHEMBL6398021 | 0.71 | — | — | |
| Iodide SCHEMBL10902850 | 0.69 | — | — | |
| Bromide SCHEMBL28441498 | 0.69 | — | — | |
| SCHEMBL4624001 | 0.69 | — | — | |
| SCHEMBL11597082 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2729179-B1 | MACROMOLECULES | STARPHARMA PTY LTD (AU) | 2020-09-23 | — | — | EP | disclosed |