⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4022308 | 0.84 | — | — | |
| SCHEMBL31099082 | 0.74 | — | — | |
| SCHEMBL29782947 | 0.69 | — | — | |
| SCHEMBL5654442 | 0.69 | — | — | |
| SCHEMBL1344323 | 0.69 | — | — | |
| SCHEMBL444343 | 0.65 | — | — | |
| SCHEMBL15940548 | 0.65 | — | — | |
| SCHEMBL22953996 | 0.65 | HTT (0.37) | — | |
| SCHEMBL13992163 | 0.63 | POLB (0.47) | — | |
| SCHEMBL31099016 | 0.61 | NOTUM (0.41) | — |
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-2024255412-A1 | SPIRO HETEROCYCLIC COMPOUND AND USE THEREOF | 广州必贝特医药股份有限公司 | 2024-12-19 | — | — | WO | disclosed |
| CN-118510780-A | Spiro heterocyclic compounds and uses thereof | 广州必贝特医药股份有限公司 | 2024-08-16 | — | — | CN | disclosed |