⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18591727 | 0.86 | — | — | |
| SCHEMBL25053665 | 0.84 | — | — | |
| SCHEMBL25636605 | 0.84 | ALDH1A1 (0.36) | — | |
| SCHEMBL20372670 | 0.83 | ALDH1A1 (0.32) | — | |
| SCHEMBL21341868 | 0.80 | POLB (0.34) | — | |
| SCHEMBL20076249 | 0.77 | ALDH1A1 (0.34) | — | |
| SCHEMBL20812252 | 0.77 | — | — | |
| SCHEMBL19606414 | 0.76 | — | — | |
| SCHEMBL20443654 | 0.75 | — | — | |
| SCHEMBL14306653 | 0.75 | CA2 (0.37) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-12036209-B2 | Compounds and methods for the targeted degradation of Interleukin-1 receptor-associated kinase 4 polypeptides | ARVINAS OPERATIONS, INC. (US) | 2024-07-16 | — | — | US | disclosed |