⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25406639 | 1.00 | — | — | |
| SCHEMBL23133030 | 1.00 | — | — | |
| SCHEMBL6591442 | 0.74 | GSK3B (0.41) | — | |
| SCHEMBL10508164 | 0.72 | — | — | |
| SCHEMBL10508166 | 0.72 | — | — | |
| SCHEMBL24846230 | 0.69 | GSK3B (0.38) | — | |
| SCHEMBL4565024 | 0.69 | GSK3B (0.39) | — | |
| SCHEMBL123424 | 0.67 | — | — | |
| SCHEMBL3254361 | 0.67 | GSK3B (0.42) | — | |
| SCHEMBL11307774 | 0.67 | GAA (0.63) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023134629-A1 | NUCLEAR TRANSPORT REGULATOR AND USE THEREOF | 上海海雁医药科技有限公司 | 2023-07-20 | — | — | WO | disclosed |
| CN-114746398-A | Headgroup lipid compounds and compositions for intracellular delivery of therapeutic agents | 摩登纳特斯有限公司 | 2022-07-12 | — | — | CN | disclosed |