⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2166969 | 0.83 | — | — | |
| SCHEMBL2169181 | 0.80 | LMNA (0.32) | — | |
| SCHEMBL2167193 | 0.77 | THRB (0.34) | — | |
| SCHEMBL2168157 | 0.76 | TSHR (0.31) | — | |
| SCHEMBL2168467 | 0.74 | PTPN1 (0.32) | — | |
| SCHEMBL2166727 | 0.73 | — | — | |
| SCHEMBL2168834 | 0.73 | USP2 (0.32) | — | |
| SCHEMBL2166827 | 0.72 | — | — | |
| SCHEMBL2166888 | 0.72 | USP2 (0.34) | — | |
| SCHEMBL30965276 | 0.69 | CHRM1 (0.34) | — |
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-8383274-B2 | Nonaqueous electrolyte solution for lithium battery, lithium battery using same, and formyloxy group-containing compound used therein | UBE INDUSTRIES, LTD. (JP) | 2013-02-26 | — | — | US | disclosed |
| US-20110183199-A1 | NONAQUEOUS ELECTROLYTE SOLUTION FOR LITHIUM BATTERY, LITHIUM BATTERY USING SAME, AND FORMYLOXY GROUP-CONTAINING COMPOUND USED THEREIN | UBE INDUSTRIES, LTD. (JP) | 2011-07-28 | — | — | US | disclosed |