⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL35282 | 0.96 | — | — | |
| SCHEMBL30952478 | 0.93 | — | — | |
| Hydrochloric Acid SCHEMBL10514755 | 0.93 | — | — | |
| SCHEMBL29586137 | 0.93 | L3MBTL3 (0.44) | — | |
| SCHEMBL3232584 | 0.90 | — | — | |
| SCHEMBL339598 | 0.90 | — | — | |
| SCHEMBL38654566 | 0.90 | — | — | |
| SCHEMBL3225027 | 0.90 | — | — | |
| SCHEMBL969472 | 0.90 | — | — | |
| SCHEMBL6194042 | 0.87 | HTR6 (0.52) | — |
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-117882732-A | Smearing agent and application thereof | 湘丰茶业集团有限公司 | 2024-04-16 | — | — | CN | disclosed |