⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1618752 | 0.97 | — | — | |
| SCHEMBL28765427 | 0.80 | — | — | |
| SCHEMBL31332333 | 0.79 | HCAR2 (0.52) | — | |
| SCHEMBL26841662 | 0.79 | TSHR (0.50) | — | |
| SCHEMBL25921 | 0.79 | — | — | |
| SCHEMBL2727797 | 0.79 | TSHR (0.50) | — | |
| SCHEMBL27402151 | 0.78 | TSHR (0.45) | — | |
| SCHEMBL864183 | 0.77 | — | — | |
| Ammonia Solution, Strong SCHEMBL1881209 | 0.77 | — | — | |
| Ethylene SCHEMBL5972217 | 0.77 | HCAR2 (0.50) | — |
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-115050922-A | Water-based binder and preparation method and application thereof | 深圳市研一新材料有限责任公司 | 2022-09-13 | — | — | CN | disclosed |