⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3819592 | 0.89 | — | — | |
| SCHEMBL453650 | 0.89 | — | — | |
| SCHEMBL27963760 | 0.89 | — | — | |
| Water SCHEMBL31182205 | 0.80 | — | — | |
| SCHEMBL31674392 | 0.80 | — | — | |
| SCHEMBL31236335 | 0.80 | — | — | |
| SCHEMBL456445 | 0.80 | — | — | |
| SCHEMBL6424649 | 0.80 | — | — | |
| Water SCHEMBL31182207 | 0.80 | — | — | |
| SCHEMBL3243837 | 0.80 | — | — |
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-RE34486-E | Compositions of inorganic-organic alloy with highly charged nitrogen content polymers and their manufacture | WALDMANN JOHN J | 1993-12-21 | — | — | US | claimed |