⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31032164 | 0.95 | — | — | |
| SCHEMBL2151684 | 0.90 | — | — | |
| SCHEMBL18366405 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL30922624 | 0.76 | — | — | |
| SCHEMBL4545419 | 0.76 | — | — | |
| SCHEMBL9387449 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL8866831 | 0.74 | — | — | |
| SCHEMBL17190111 | 0.73 | — | — | |
| SCHEMBL21593265 | 0.73 | — | — | |
| SCHEMBL21593235 | 0.73 | — | — |
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-2023141852-A1 | CDK2 INHIBITORS, PREPARATION METHOD THEREFOR AND USE THEREOF | 益方生物科技(上海)股份有限公司 | 2023-08-03 | — | — | WO | disclosed |