⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7017538 | 1.00 | — | — | |
| SCHEMBL11150839 | 1.00 | — | — | |
| Water SCHEMBL718584 | 1.00 | — | — | |
| Water SCHEMBL718583 | 1.00 | — | — | |
| SCHEMBL9479865 | 0.95 | — | — | |
| SCHEMBL27792116 | 0.95 | — | — | |
| SCHEMBL15477456 | 0.95 | — | — | |
| Hydrochloric Acid SCHEMBL28223010 | 0.95 | — | — | |
| SCHEMBL21545000 | 0.95 | — | — | |
| SCHEMBL17311360 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9929425-B2 | High solubility iron hexacyanides | LOCKHEED MARTIN ADVANCED ENERGY STORAGE, LLC (US) | 2018-03-27 | — | — | US | claimed |
| WO-2013141861-A1 | SECONDARY REDOX FLOW BATTERY AND METHOD OF MAKING SAME | ZINC AIR INCORPORATED (US) | 2013-09-26 | — | — | WO | disclosed |
| US-20130252062-A1 | SECONDARY REDOX FLOW BATTERY AND METHOD OF MAKING SAME | ZINC AIR, INC. (US) | 2013-09-26 | — | — | US | disclosed |