⚠ 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 | |
|---|---|---|---|---|
| Peroxynitrite SCHEMBL15117 | 1.00 | — | — | |
| Peroxynitrite SCHEMBL17180226 | 0.95 | — | — | |
| Peroxynitrite SCHEMBL14964652 | 0.95 | — | — | |
| Peroxynitrite SCHEMBL30148125 | 0.95 | — | — | |
| Peroxynitrite SCHEMBL28447690 | 0.95 | — | — | |
| Peroxynitrite SCHEMBL28863409 | 0.95 | — | — | |
| Peroxynitrite SCHEMBL28300144 | 0.91 | — | — | |
| Peroxynitrite SCHEMBL1324560 | 0.91 | — | — | |
| Peroxynitrite SCHEMBL27699043 | 0.91 | — | — | |
| Bicarbonate SCHEMBL15412927 | 0.87 | — | — |
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 9 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107207606-A | Antigen binding constructs, i.e. single domain VHH fragments, that bind to and inhibit catalase and/or superoxide dismutase and pharmaceutical compositions containing them for tumor therapy | 乔治.鲍尔 | 2017-09-26 | — | — | CN | disclosed |
| CN-105431131-A | Skin care compositions | UNILEVER NV | 2016-03-23 | — | — | CN | disclosed |
| CN-103054877-B | Composition containing alisol A and application of composition containing alisol A on medicine | SHANGHAI MODERN PHARMACEUTICAL ENGINEERING RES CT CO LTD | 2014-06-11 | — | — | CN | disclosed |
| CN-103054877-A | Composition containing alisol A and application of composition containing alisol A on medicine | SHANGHAI MODERN PHARMACEUTICAL ENGINEERING RES CT CO LTD | 2013-04-24 | — | — | CN | disclosed |
| CN-103054878-A | Application of alisol A23-acetic acid ester for preparing medicine for treating hyperlipidemia | SHANGHAI MODERN PHARMACEUTICAL ENGINEERING RES CT CO LTD | 2013-04-24 | — | — | CN | disclosed |
| CN-102858353-A | Spinal cord injury, inflammation, and immune-disease: local controlled release of therapeutic agents | INVIVO THERAPEUTICS CORP | 2013-01-02 | — | — | CN | disclosed |
| EP-1159283-A4 | MITOCHONDRIAL DNA DAMAGE AS A PREDICTOR OF CORONARY ATHEROSCLEROTIC HEART DISEASE | RES DEV FOUNDATION (US) | 2004-12-15 | — | — | EP | disclosed |
| EP-1159283-A2 | MITOCHONDRIAL DNA DAMAGE AS A PREDICTOR OF CORONARY ATHEROSCLEROTIC HEART DISEASE | RESEARCH DEVELOPMENT FOUNDATION (US) | 2001-12-05 | — | — | EP | disclosed |
| WO-2000041610-A2 | MITOCHONDRIAL DNA DAMAGE AS A PREDICTOR OF CORONARY ATHEROSCLEROTIC HEART DISEASE | RESEARCH DEVELOPMENT FOUNDATION (US) | 2000-07-20 | — | — | WO | disclosed |