⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL2175030 | 0.98 | SMN1; SMN2 (0.52) | — | |
| SCHEMBL34729 | 0.97 | — | — | |
| SCHEMBL30771552 | 0.95 | — | — | |
| Iodide SCHEMBL410828 | 0.95 | — | — | |
| Bromide SCHEMBL28437157 | 0.95 | SMN1; SMN2 (0.53) | — | |
| Fluoride Ion SCHEMBL635144 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL194564 | 0.95 | — | — | |
| Bromide SCHEMBL193043 | 0.95 | — | — | |
| Hydrogen Sulfide SCHEMBL16733052 | 0.95 | — | — | |
| Water SCHEMBL409263 | 0.95 | — | — |
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-20120011886-A1 | IONIC COMPOUNDS IN LITHIUM BROMIDE/WATER ABSORPTION CYCLE SYSTEMS | E. I. DU PONT DE NEMOURS AND COMPANY | 2012-01-19 | — | — | US | disclosed |