⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29488585 | 0.93 | — | — | |
| SCHEMBL29488588 | 0.92 | CES2 (0.33) | — | |
| SCHEMBL4457552 | 0.90 | TDP1 (0.30) | — | |
| SCHEMBL29488608 | 0.87 | ALDH1A1 (0.32) | — | |
| SCHEMBL29488604 | 0.87 | CYP2C19 (0.32) | — | |
| SCHEMBL29488606 | 0.86 | PLA2G4B (0.31) | — | |
| SCHEMBL29488595 | 0.84 | CES2 (0.33) | — | |
| SCHEMBL4457981 | 0.84 | TDP1 (0.31) | — | |
| SCHEMBL29420375 | 0.84 | — | — | |
| SCHEMBL29488594 | 0.83 | CES2 (0.36) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4001359-B1 | SULPHUR-LINKABLE RUBBER COMPOUND, VULCANIZATE OF THE RUBBER COMPOUND AND VEHICLE TYRES | CONTINENTAL REIFEN DEUTSCHLAND GMBH (DE) | 2025-09-03 | — | — | EP | disclosed |
| US-11542286-B2 | Silane mixtures and process for preparing same | EVONIK OPERATIONS GMBH (DE) | 2023-01-03 | — | — | US | disclosed |
| CN-111386199-B | Sulfur-crosslinkable rubber mixture, vulcanized rubber of rubber mixture and vehicle tire | 大陆轮胎德国有限公司 | 2022-05-31 | — | — | CN | disclosed |
| EP-4001359-A1 | SULPHUR-LINKABLE RUBBER COMPOUND, VULCANIZATE OF THE RUBBER COMPOUND AND VEHICLE TYRES | Continental Reifen Deutschland GmbH (DE) | 2022-05-25 | — | — | EP | disclosed |
| CN-109971034-B | Silane mixture and method for the production thereof | 赢创运营有限公司 | 2022-03-08 | — | — | CN | disclosed |