⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2904 | 0.93 | — | — | |
| SCHEMBL27946387 | 0.93 | — | — | |
| SCHEMBL117680 | 0.86 | — | — | |
| Water SCHEMBL4084932 | 0.86 | — | — | |
| SCHEMBL1525584 | 0.86 | — | — | |
| Water SCHEMBL3270886 | 0.86 | — | — | |
| SCHEMBL3860578 | 0.86 | — | — | |
| SCHEMBL7397565 | 0.86 | — | — | |
| SCHEMBL8500942 | 0.86 | — | — | |
| SCHEMBL6437799 | 0.86 | — | — |
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-117603107-A | Perfluoro hydrocarbon thio silver reagent and preparation and application method thereof | 万博新材料科技（南通）有限公司 | 2024-02-27 | — | — | CN | disclosed |
| US-20230299385-A1 | TEMPERATURE SENSITIVE COATINGS | UT BATTELLE LLC (US) | 2023-09-21 | — | — | US | disclosed |