⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL216 | 0.78 | — | — | |
| SCHEMBL2941899 | 0.78 | — | — | |
| Methylene Chloride SCHEMBL2007629 | 0.74 | — | — | |
| SCHEMBL31401816 | 0.72 | — | — | |
| Iodide SCHEMBL7121770 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL28769006 | 0.72 | — | — | |
| Methylene Chloride SCHEMBL4743036 | 0.70 | — | — | |
| SCHEMBL18108160 | 0.67 | — | — | |
| SCHEMBL8153567 | 0.67 | — | — | |
| SCHEMBL10360393 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2005082964-A1 | COPOLYMER WITH PHOSPHORYL GROUP AND VARIOUS ARTICLES OF SAME | EBARA CORPORATION (JP) | 2005-09-09 | — | — | WO | disclosed |