⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28175517 | 0.89 | — | — | |
| SCHEMBL18541674 | 0.79 | LMNA (0.41) | — | |
| SCHEMBL5167501 | 0.77 | POLB (0.46) | — | |
| SCHEMBL12362576 | 0.76 | — | — | |
| SCHEMBL12245645 | 0.76 | — | — | |
| SCHEMBL246371 | 0.76 | — | — | |
| SCHEMBL1733973 | 0.75 | LMNA (0.52) | — | |
| SCHEMBL812840 | 0.75 | LMNA (0.52) | — | |
| SCHEMBL3670365 | 0.75 | LMNA (0.45) | — | |
| SCHEMBL26512462 | 0.73 | CHRM2 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023183585-A1 | KRAS INHIBITORS | ELI LILLY AND COMPANY (US) | 2023-09-28 | — | — | WO | disclosed |