⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11168673 | 0.76 | SIGMAR1 (0.33) | — | |
| SCHEMBL25917697 | 0.74 | — | — | |
| SCHEMBL15271418 | 0.73 | CA1 (0.35) | — | |
| SCHEMBL12913566 | 0.72 | — | — | |
| SCHEMBL24799478 | 0.71 | CA1 (0.32) | — | |
| SCHEMBL14959703 | 0.71 | THRB (0.41) | — | |
| SCHEMBL11317416 | 0.71 | TSHR (0.46) | — | |
| SCHEMBL776031 | 0.71 | — | — | |
| SCHEMBL11283698 | 0.71 | — | — | |
| SCHEMBL24481594 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4297439-A | IN THE PRESENCE OF A DITHIO ETHER; ANTIFOGGING AGENTS | AGFA-GEVAERT AG (DE) | 1981-10-27 | — | — | US | disclosed |
| EP-0005804-B1 | PHOTOGRAPHIC MATERIALS, PROCESS FOR THEIR PREPARATION AS WELL AS THE PRODUCTION OF PHOTOGRAPHIC IMAGES AND THIOETHERS | Agfa-Gevaert AG (DE) | 1980-11-26 | — | — | EP | disclosed |
| EP-0005804-A1 | Photographic materials, process for their preparation as well as the production of photographic images and thioethers | Agfa-Gevaert AG (DE) | 1979-12-12 | — | — | EP | disclosed |