⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9853835 | 0.70 | — | — | |
| SCHEMBL4648997 | 0.63 | — | — | |
| SCHEMBL2135291 | 0.54 | — | — | |
| SCHEMBL4647701 | 0.53 | — | — | |
| SCHEMBL4644223 | 0.52 | — | — | |
| SCHEMBL497934 | 0.51 | — | — | |
| Hydrochloric Acid SCHEMBL19732802 | 0.51 | — | — | |
| SCHEMBL602116 | 0.51 | — | — | |
| SCHEMBL4645642 | 0.50 | — | — | |
| SCHEMBL8220510 | 0.49 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2448056-A1 | LITHIUM-ION SECONDARY BATTERY | Hitachi Vehicle Energy, Ltd. (JP) | 2012-05-02 | — | — | EP | disclosed |
| US-20120100436-A1 | LITHIUM-ION SECONDARY BATTERY | HITACHI VEHICLE ENERGY, LTD. (JP) | 2012-04-26 | — | — | US | disclosed |