⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL54546 | 0.80 | — | — | |
| SCHEMBL3340820 | 0.77 | ALDH1A1 (0.50) | — | |
| SCHEMBL6056950 | 0.76 | — | — | |
| SCHEMBL28883771 | 0.76 | — | — | |
| SCHEMBL28172816 | 0.76 | — | — | |
| Ethylene SCHEMBL9958102 | 0.72 | — | — | |
| SCHEMBL8571612 | 0.69 | — | — | |
| SCHEMBL7745865 | 0.69 | — | — | |
| SCHEMBL28273409 | 0.69 | — | — | |
| Cyclopentane SCHEMBL9246771 | 0.69 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20050234255-A1 | Electrochemical method for the production of organofunctional silanes | Consortium für elektrochemische Industrie GmbH (DE) | 2005-10-20 | — | — | US | claimed |