⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL31113374 | 0.68 | — | — | |
| SCHEMBL17922042 | 0.65 | — | — | |
| SCHEMBL13911385 | 0.60 | — | — | |
| SCHEMBL13535732 | 0.60 | — | — | |
| SCHEMBL19752340 | 0.60 | — | — | |
| SCHEMBL13957201 | 0.60 | SIGMAR1 (0.31) | — | |
| SCHEMBL16104884 | 0.60 | — | — | |
| SCHEMBL16230067 | 0.60 | — | — | |
| SCHEMBL24201550 | 0.60 | — | — | |
| SCHEMBL24796792 | 0.59 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114430743-A | Thyroid hormone receptor beta agonist compounds | 拓臻制药公司 | 2022-05-03 | — | — | CN | disclosed |