⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14912717 | 0.80 | CHRM4 (0.36) | — | |
| SCHEMBL28731684 | 0.77 | ADORA3 (0.32) | — | |
| SCHEMBL22650538 | 0.73 | — | — | |
| SCHEMBL21114102 | 0.69 | HRH4 (0.37) | — | |
| SCHEMBL31211037 | 0.68 | PDE10A (0.36) | — | |
| SCHEMBL31419475 | 0.68 | ADORA2A (0.37) | — | |
| SCHEMBL22650529 | 0.66 | PIM1 (0.34) | — | |
| SCHEMBL24121824 | 0.66 | CHRM4 (0.36) | — | |
| SCHEMBL14912061 | 0.66 | ADORA2A (0.57) | — | |
| SCHEMBL21265906 | 0.66 | MEN1 (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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-120040446-A | CDK inhibitors | 基因泰克公司 | 2025-05-27 | — | — | CN | disclosed |
| US-20220296595-A1 | CDK INHIBITORS | GENENTECH, INC. | 2022-09-22 | — | — | US | disclosed |
| CN-114364675-A | CDK inhibitors | 上海齐鲁锐格医药研发有限公司 | 2022-04-15 | — | — | CN | disclosed |
| EP-3966213-A1 | CDK INHIBITORS | Qilu Regor Therapeutics Inc. (CN) | 2022-03-16 | — | — | EP | disclosed |