⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28028308 | 0.80 | — | — | |
| SCHEMBL27681592 | 0.77 | — | — | |
| SCHEMBL5354 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL22164315 | 0.74 | CA5A (0.33) | — | |
| Hydrochloric Acid SCHEMBL2671055 | 0.72 | — | — | |
| SCHEMBL29973 | 0.72 | — | — | |
| Fluoride SCHEMBL11339901 | 0.72 | — | — | |
| SCHEMBL7586263 | 0.72 | — | — | |
| SCHEMBL23269 | 0.72 | CA5A (0.39) | — | |
| SCHEMBL8382225 | 0.72 | CA5A (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-116940236-A | Composition containing benzylamine acaricide and application thereof | 山东康乔生物科技有限公司 | 2023-10-24 | — | — | CN | claimed |
| CN-116940236-A | Composition containing benzylamine acaricide and application thereof | 山东康乔生物科技有限公司 | 2023-10-24 | — | — | CN | disclosed |