⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL618231 | 0.89 | — | — | |
| SCHEMBL414506 | 0.89 | — | — | |
| SCHEMBL28265627 | 0.89 | — | — | |
| Water SCHEMBL2151423 | 0.80 | — | — | |
| Water SCHEMBL23581908 | 0.80 | — | — | |
| SCHEMBL22129680 | 0.78 | — | — | |
| SCHEMBL2247 | 0.78 | — | — | |
| SCHEMBL21986958 | 0.67 | — | — | |
| SCHEMBL22264134 | 0.67 | — | — | |
| SCHEMBL20854829 | 0.67 | — | — |
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-109476937-B | Dispersion and sprayable composition containing metal oxide nanoparticles | 惠普发展公司，有限责任合伙企业 | 2021-08-27 | — | — | CN | disclosed |