⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14946655 | 0.74 | — | — | |
| SCHEMBL14780498 | 0.71 | ALOX5 (0.38) | — | |
| SCHEMBL14780444 | 0.70 | — | — | |
| SCHEMBL14778621 | 0.68 | EPHX2 (0.36) | — | |
| SCHEMBL14779049 | 0.66 | CA1 (0.30) | — | |
| SCHEMBL28024122 | 0.65 | ALDH1A1 (0.44) | — | |
| SCHEMBL14779965 | 0.63 | — | — | |
| SCHEMBL18622106 | 0.63 | ALDH1A1 (0.42) | — | |
| SCHEMBL28024120 | 0.63 | ALDH1A1 (0.42) | — | |
| SCHEMBL5422379 | 0.62 | LMNA (0.38) | — |
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-9240614-B2 | Nonaqueous electrolyte solution and electrochemical element using same | UBE INDUSTRIES, LTD. (JP) | 2016-01-19 | — | — | US | disclosed |
| US-20130071733-A1 | NONAQUEOUS ELECTROLYTE SOLUTION AND ELECTROCHEMICAL ELEMENT USING SAME | UBE INDUSTRIES, LTD. (JP) | 2013-03-21 | — | — | US | disclosed |