⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11616134 | 0.79 | — | — | |
| SCHEMBL6907374 | 0.77 | — | — | |
| SCHEMBL11620874 | 0.77 | — | — | |
| SCHEMBL268640 | 0.74 | — | — | |
| SCHEMBL8523778 | 0.74 | — | — | |
| SCHEMBL6253396 | 0.72 | TSHR (0.30) | — | |
| SCHEMBL6255195 | 0.72 | TSHR (0.30) | — | |
| SCHEMBL15153090 | 0.71 | — | — | |
| SCHEMBL1396032 | 0.71 | — | — | |
| Ammonia Solution, Strong SCHEMBL12502446 | 0.71 | — | — |
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-9391345-B2 | Non-aqueous electrolytes for electrochemical cells | UCHICAGO ARGONNE, LLC (US) | 2016-07-12 | — | — | US | disclosed |
| US-20120082890-A1 | NON-AQUEOUS ELECTROLYTES FOR ELECTROCHEMICAL CELLS | UCHICAGO ARGONNE, LLC | 2012-04-05 | — | — | US | disclosed |