⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16865203 | 0.94 | ALDH1A1 (0.33) | — | |
| SCHEMBL16865193 | 0.91 | — | — | |
| SCHEMBL16865192 | 0.86 | ALDH1A1 (0.33) | — | |
| SCHEMBL15960844 | 0.82 | TSHR (0.34) | — | |
| SCHEMBL15960833 | 0.80 | ACACB (0.32) | — | |
| SCHEMBL102472 | 0.79 | POLB (0.41) | — | |
| SCHEMBL18621789 | 0.78 | DPP4 (0.34) | — | |
| SCHEMBL5357320 | 0.78 | LMNA (0.44) | — | |
| SCHEMBL16865172 | 0.78 | — | — | |
| SCHEMBL13756088 | 0.77 | THRB (0.46) | — |
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-20150188193-A1 | NON-AQUEOUS LIQUID ELECTROLYTE FOR SECONDARY BATTERY AND SECONDARY BATTERY | FUJIFILM CORPORATION (JP) | 2015-07-02 | — | — | US | disclosed |
| US-20150188193-A1 | NON-AQUEOUS LIQUID ELECTROLYTE FOR SECONDARY BATTERY AND SECONDARY BATTERY | FUJIFILM CORPORATION (JP) | 2015-07-02 | — | — | US | disclosed |