⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1858117 | 0.59 | — | — | |
| SCHEMBL907353 | 0.59 | — | — | |
| SCHEMBL874006 | 0.56 | — | — | |
| SCHEMBL20869237 | 0.56 | — | — | |
| Fluoride SCHEMBL21682602 | 0.56 | — | — | |
| SCHEMBL14535429 | 0.56 | — | — | |
| SCHEMBL22136409 | 0.56 | — | — | |
| SCHEMBL12236935 | 0.56 | — | — | |
| SCHEMBL685180 | 0.54 | — | — | |
| SCHEMBL882948 | 0.54 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20160372788-A1 | ELECTROLYTE FORMULATIONS FOR LITHIUM ION BATTERIES | JOHNSON CONTROLS TECHNOLOGY COMPANY (US) | 2016-12-22 | — | — | US | disclosed |