⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1325684 | 0.73 | — | — | |
| SCHEMBL20836935 | 0.73 | — | — | |
| SCHEMBL20608619 | 0.72 | CA1 (0.34) | — | |
| SCHEMBL20608620 | 0.72 | CA1 (0.34) | — | |
| SCHEMBL20610524 | 0.72 | CA1 (0.34) | — | |
| SCHEMBL895048 | 0.71 | — | — | |
| SCHEMBL9681669 | 0.71 | CA1 (0.46) | — | |
| SCHEMBL9681659 | 0.71 | CA1 (0.46) | — | |
| SCHEMBL6803655 | 0.70 | CA1 (0.32) | — | |
| SCHEMBL5810840 | 0.70 | CA1 (0.32) | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101160684-A | Novel redox shuttle compounds for overcharge protection of lithium batteries | UNIV CHICAGO (US) | 2008-04-09 | — | — | CN | claimed |
| CN-109476688-A | Modified ionic liquid comprising phosphorus | 诺姆斯技术公司 | 2019-03-15 | — | — | CN | disclosed |
| CN-108701866-A | Silane-functionalised ionic liquid | 诺姆斯科技有限公司 | 2018-10-23 | — | — | CN | disclosed |
| CN-103553886-A | Polyether-functionalized redox shuttle additives for lithium ion batteries | UCHICAGO ARGONNE LLC | 2014-02-05 | — | — | CN | disclosed |
| CN-102918701-A | Polyether functionalized redox shuttle additives for lithium ion batteries | UCHICAGO ARGONNE LLC | 2013-02-06 | — | — | CN | disclosed |
| CN-101160684-A | Novel redox shuttle compounds for overcharge protection of lithium batteries | UNIV CHICAGO (US) | 2008-04-09 | — | — | CN | disclosed |