⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3261343 | 0.96 | — | — | |
| SCHEMBL38188 | 0.96 | — | — | |
| Potassium SCHEMBL30607080 | 0.92 | — | — | |
| Water SCHEMBL27652010 | 0.92 | — | — | |
| SCHEMBL959385 | 0.92 | — | — | |
| Lithium SCHEMBL30271121 | 0.92 | — | — | |
| Ammonia Solution, Strong SCHEMBL10617791 | 0.92 | — | — | |
| SCHEMBL4229276 | 0.92 | — | — | |
| SCHEMBL10524134 | 0.92 | — | — | |
| Lithium Ion SCHEMBL10526254 | 0.88 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20220263116-A1 | BORON CONTAINING ELECTROLYTES AND METHODS OF FORMING BORON CONTAINING ELECTROLYTES FOR MAGNESIUM BATTERIES | TOYOTA MOTOR ENGINEERING & MANUFACTURING NORTH AMERICA, INC. | 2022-08-18 | — | — | US | disclosed |
| US-4808282-A | REPLACEMENT OF ALKALI METAL IN LIQUID ELECTROLYTE COMPOUND WITH ALKALI EARTH METAL | THE DOW CHEMICAL COMPANY (US) | 1989-02-28 | — | — | US | disclosed |