⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22029169 | 0.83 | — | — | |
| SCHEMBL24616254 | 0.83 | — | — | |
| SCHEMBL27053763 | 0.83 | — | — | |
| SCHEMBL24616246 | 0.83 | CYP3A4 (0.31) | — | |
| SCHEMBL30101999 | 0.83 | — | — | |
| SCHEMBL16647241 | 0.75 | — | — | |
| SCHEMBL23541046 | 0.75 | CYP1A2 (0.30) | — | |
| SCHEMBL31422683 | 0.75 | CYP1A2 (0.30) | — | |
| SCHEMBL27053770 | 0.73 | NQO2 (0.31) | — | |
| SCHEMBL31491019 | 0.72 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20240140957-A1 | BRIDGED COMPOUNDS AS KRAS G12D INHIBITOR AND DEGRADER AND THE USE THEREOF | BEONE MEDICINES I GMBH (CH) | 2024-05-02 | — | — | US | disclosed |
| WO-2022148422-A1 | BRIDGED COMPOUNDS AS KRAS G12D INHIBITOR AND DEGRADER AND THE USE THEREOF | BEIGENE, LTD. (KY) | 2022-07-14 | — | — | WO | disclosed |