⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25951371 | 0.87 | — | — | |
| SCHEMBL1929396 | 0.73 | — | — | |
| SCHEMBL1886832 | 0.67 | — | — | |
| SCHEMBL27282431 | 0.65 | — | — | |
| SCHEMBL13222586 | 0.65 | — | — | |
| SCHEMBL21257317 | 0.65 | — | — | |
| SCHEMBL21257318 | 0.65 | — | — | |
| SCHEMBL21257258 | 0.65 | — | — | |
| SCHEMBL21257314 | 0.65 | — | — | |
| SCHEMBL171561 | 0.65 | SLC6A4 (0.32) | — |
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-11773082-B2 | CDK2 inhibitors | PFIZER INC. (US) | 2023-10-03 | — | — | US | disclosed |
| US-11014911-B2 | CDK2 inhibitors | PFIZER INC. (US) | 2021-05-25 | — | — | US | disclosed |