⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25226 | 0.95 | — | — | |
| SCHEMBL7992175 | 0.95 | — | — | |
| SCHEMBL7402873 | 0.95 | — | — | |
| Ammonia Solution, Strong SCHEMBL28541874 | 0.91 | — | — | |
| SCHEMBL14352041 | 0.91 | — | — | |
| SCHEMBL1525314 | 0.91 | — | — | |
| SCHEMBL28583701 | 0.81 | TSHR (0.33) | — | |
| SCHEMBL16280747 | 0.73 | — | — | |
| SCHEMBL7740452 | 0.72 | TSHR (0.33) | — | |
| SCHEMBL302698 | 0.70 | — | — |
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-6245465-B1 | ELECTROLYTES AND ELECTRIC CURRENTS WITH SULFONES | MOLTECH CORPORATION | 2001-06-12 | — | — | US | disclosed |
| WO-1999019932-A1 | NON-AQUEOUS ELECTROLYTE SOLVENTS FOR SECONDARY CELLS | MOLTECH CORPORATION (US) | 1999-04-22 | — | — | WO | disclosed |