⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL464803 | 0.81 | — | — | |
| SCHEMBL2142345 | 0.79 | — | — | |
| SCHEMBL464819 | 0.73 | — | — | |
| SCHEMBL27500424 | 0.71 | — | — | |
| SCHEMBL17472928 | 0.71 | — | — | |
| SCHEMBL4340354 | 0.69 | — | — | |
| SCHEMBL8450805 | 0.67 | — | — | |
| SCHEMBL214066 | 0.66 | — | — | |
| SCHEMBL757007 | 0.65 | — | — | |
| SCHEMBL9566341 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0116638-A1 | PROSTHESES CONTACT LENSES AND POLYMERS THEREFOR | CONTACT LENSES (MANUFACTURING) LIMITED (GB) | 1984-08-29 | — | — | EP | claimed |
| WO-1984000969-A1 | PROSTHESES CONTACT LENSES AND POLYMERS THEREFOR | CONTACT LENS MFG LTD (GB) | 1984-03-15 | — | — | WO | claimed |
| CN-107987680-B | Water-based epoxy graphene anticorrosive paint | 海洋化工研究院有限公司 | 2020-02-07 | — | — | CN | disclosed |