⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL28674707 | 0.87 | — | — | |
| Ammonia Solution, Strong SCHEMBL4352468 | 0.82 | — | — | |
| SCHEMBL158732 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL3262349 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL253334 | 0.82 | — | — | |
| SCHEMBL23302898 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL5962011 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL1121209 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL5962028 | 0.82 | — | — | |
| Ammonia Solution, Strong SCHEMBL9405087 | 0.82 | — | — |
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-2007150027-A2 | SYSTEM AND METHOD FOR REMOVING A DISSOLVED SUBSTANCE FROM A SOLUTION | KANSAS STATE UNIVERSITY RESEARCH FOUNDATION (US) | 2007-12-27 | — | — | WO | disclosed |