⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3591421 | 0.80 | — | — | |
| SCHEMBL9750462 | 0.71 | — | — | |
| SCHEMBL30146940 | 0.58 | MEN1 (0.44) | — | |
| SCHEMBL28804 | 0.55 | — | — | |
| SCHEMBL20115662 | 0.55 | — | — | |
| SCHEMBL7829463 | 0.55 | — | — | |
| SCHEMBL88697 | 0.55 | — | — | |
| SCHEMBL441202 | 0.55 | — | — | |
| SCHEMBL4299597 | 0.55 | — | — | |
| SCHEMBL4274081 | 0.53 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0212569-B1 | THIATION PROCESS | ETHYL CORPORATION (US) | 1991-05-22 | — | — | EP | disclosed |
| US-4935514-A | Thiation process | ETHYL CORPORATION (US) | 1990-06-19 | — | — | US | disclosed |
| US-4935510-A | Thiation process | ETHYL CORPORATION (US) | 1990-06-19 | — | — | US | disclosed |
| US-4935513-A | Thiation process | ETHYL CORPORATION (US) | 1990-06-19 | — | — | US | disclosed |
| US-4663452-A | Thiation process | ETHYL CORPORATION (US) | 1987-05-05 | — | — | US | disclosed |
| EP-0212569-A2 | Thiation process | ETHYL CORPORATION (US) | 1987-03-04 | — | — | EP | disclosed |