⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL190697 | 0.67 | — | — | |
| SCHEMBL19717570 | 0.67 | — | — | |
| SCHEMBL3401344 | 0.65 | — | — | |
| SCHEMBL8402768 | 0.65 | — | — | |
| SCHEMBL8781922 | 0.65 | — | — | |
| SCHEMBL11065464 | 0.65 | — | — | |
| SCHEMBL1584094 | 0.65 | — | — | |
| SCHEMBL380943 | 0.64 | ALDH1A1 (0.33) | — | |
| SCHEMBL6936517 | 0.62 | — | — | |
| SCHEMBL216833 | 0.61 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-111378141-B | Force-induced response supramolecular polymer | 厦门天策材料科技有限公司 | 2023-04-07 | — | — | CN | disclosed |
| CN-111378141-A | Force-induced response supramolecular polymer | 翁秋梅 | 2020-07-07 | — | — | CN | disclosed |
| US-5686021-A | Liquid crystal display device, methods of producing and driving the liquid crystal display device, and liquid crystal composition | IDEMITSU KOSAN CO., LTD. (JP) | 1997-11-11 | — | — | US | disclosed |