⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22490959 | 0.89 | CA1 (0.35) | — | |
| SCHEMBL31126318 | 0.80 | CA1 (0.52) | — | |
| SCHEMBL18574650 | 0.79 | CA1 (0.32) | — | |
| SCHEMBL5593702 | 0.79 | CA1 (0.32) | — | |
| SCHEMBL17509760 | 0.77 | CA1 (0.30) | — | |
| SCHEMBL5586201 | 0.77 | CA1 (0.30) | — | |
| SCHEMBL17865364 | 0.77 | CA1 (0.30) | — | |
| SCHEMBL12902280 | 0.75 | — | — | |
| SCHEMBL12902479 | 0.75 | CA1 (0.46) | — | |
| SCHEMBL19853492 | 0.75 | NPSR1 (0.32) | — |
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-6120941-A | COMPRISING AN AZA-ETHER BASED COMPOUNDS ACTS AS NEUTRAL RECEPTORS TO COMPLEX THE ANION MOIETY OF THE ELECTROLYTE SALT TO INCREASE THE CONDUCTIVITY IN ALKALI METAL BATTERIES | BROOKHAVEN SCIENCE ASSOCIATES (US) | 2000-09-19 | — | — | US | disclosed |
| US-5789585-A | IMPROVING CONDUCTIVITY OF ELECTROLYTES IN LITHIUM BATTERIES, COMPLEXING THE ANIONS | BROOKHAVEN SCIENCE ASSOCIATES LLC (US) | 1998-08-04 | — | — | US | disclosed |
| US-5705689-A | CROWN COMPOUNDS FOR BATTERY ELECTROLYTES WITH LITHIUM IONS | ASSOCIATED UNIVERSITIES, INC. (US) | 1998-01-06 | — | — | US | disclosed |