⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21145432 | 1.00 | — | — | |
| SCHEMBL2885127 | 1.00 | — | — | |
| SCHEMBL2977209 | 0.93 | — | — | |
| SCHEMBL9036563 | 0.81 | — | — | |
| SCHEMBL294016 | 0.75 | — | — | |
| SCHEMBL12726564 | 0.72 | — | — | |
| SCHEMBL1132942 | 0.72 | — | — | |
| SCHEMBL158812 | 0.72 | — | — | |
| SCHEMBL3078401 | 0.71 | HRH3 (0.32) | — | |
| SCHEMBL4714512 | 0.71 | CHRM5 (0.43) | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-10471054-B2 | CDK1 inhibitors of acetyl chrysin mannich base derivatives, synthesis and use thereof | Zhang, Fan (CN) | 2019-11-12 | — | — | US | claimed |
| US-20190216792-A1 | CDK1 INHIBITORS OF ACETYL CHRYSIN MANNICH BASE DERIVATIVES, SYNTHESIS AND USE THEREOF | ZHANG, FAN (CN) | 2019-07-18 | — | — | US | claimed |
| US-10471054-B2 | CDK1 inhibitors of acetyl chrysin mannich base derivatives, synthesis and use thereof | Zhang, Fan (CN) | 2019-11-12 | — | — | US | disclosed |
| US-20190216792-A1 | CDK1 INHIBITORS OF ACETYL CHRYSIN MANNICH BASE DERIVATIVES, SYNTHESIS AND USE THEREOF | ZHANG, FAN (CN) | 2019-07-18 | — | — | US | disclosed |