⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3628353 | 0.60 | — | — | |
| SCHEMBL9616646 | 0.49 | — | — | |
| SCHEMBL3214819 | 0.43 | — | — | |
| SCHEMBL15637581 | 0.43 | — | — | |
| SCHEMBL12370497 | 0.43 | — | — | |
| Fluoride Ion SCHEMBL28671380 | 0.41 | — | — | |
| SCHEMBL29092639 | 0.41 | — | — | |
| Hydrochloric Acid SCHEMBL29136594 | 0.41 | — | — | |
| Tetramethylammonium Ion SCHEMBL27837338 | 0.41 | — | — | |
| SCHEMBL8975626 | 0.41 | — | — |
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-7709158-B1 | Guanidine derivatives as cations for ambient temperature molten sales in electrochemical power sources | ELECTROCHEM SOLUTIONS, INC. (US) | 2010-05-04 | — | — | US | disclosed |