⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19723446 | 0.81 | — | — | |
| SCHEMBL25794490 | 0.78 | — | — | |
| SCHEMBL1143251 | 0.71 | — | — | |
| SCHEMBL1839299 | 0.71 | — | — | |
| SCHEMBL1016895 | 0.71 | — | — | |
| SCHEMBL127427 | 0.69 | — | — | |
| SCHEMBL14346468 | 0.69 | TDP1 (0.33) | — | |
| SCHEMBL19428355 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL10354119 | 0.69 | — | — | |
| SCHEMBL19723315 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-121586856-A | Optical materials derived from polymerizable compositions containing terminal alkyne and thiol functionalities | 依视路国际公司 | 2026-02-27 | — | — | CN | disclosed |
| EP-4495639-B1 | OPTICAL MATERIAL DERIVED FROM A POLYMERIZABLE COMPOSITION CONTAINING TERMINAL ALKYNE AND THIOL FUNCTIONS | ESSILOR INT (FR) | 2026-01-21 | — | — | EP | disclosed |
| WO-2025017199-A1 | OPTICAL MATERIAL DERIVED FROM A POLYMERIZABLE COMPOSITION CONTAINING TERMINAL ALKYNE AND THIOL FUNCTIONS | ESSILOR INTERNATIONAL (FR) | 2025-01-23 | — | — | WO | disclosed |
| EP-4495639-A1 | OPTICAL MATERIAL DERIVED FROM A POLYMERIZABLE COMPOSITION CONTAINING TERMINAL ALKYNE AND THIOL FUNCTIONS | Essilor International (FR) | 2025-01-22 | — | — | EP | disclosed |