⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL27799665 | 0.97 | TSHR (1.00) | — | |
| SCHEMBL15072 | 0.97 | — | — | |
| SCHEMBL30512313 | 0.95 | — | — | |
| Ammonia Solution, Strong SCHEMBL22401379 | 0.95 | — | — | |
| SCHEMBL29242364 | 0.95 | — | — | |
| Water SCHEMBL23706522 | 0.95 | — | — | |
| SCHEMBL5940648 | 0.95 | TSHR (0.95) | — | |
| SCHEMBL9245718 | 0.95 | — | — | |
| SCHEMBL29515773 | 0.95 | — | — | |
| SCHEMBL29262255 | 0.95 | — | — |
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-116376059-A | Thermal response interpenetrating network hydrogel, preparation method and forward osmosis application | 西安建筑科技大学 | 2023-07-04 | — | — | CN | disclosed |