⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19491347 | 0.84 | — | — | |
| SCHEMBL9909114 | 0.69 | — | — | |
| SCHEMBL15940521 | 0.67 | — | — | |
| SCHEMBL8882266 | 0.67 | — | — | |
| SCHEMBL19886832 | 0.67 | — | — | |
| SCHEMBL12296156 | 0.67 | — | — | |
| SCHEMBL14052202 | 0.62 | — | — | |
| SCHEMBL15268205 | 0.62 | — | — | |
| SCHEMBL19622241 | 0.62 | — | — | |
| SCHEMBL13956304 | 0.59 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-107580595-A | Heterocyclic compounds and their use in the prevention or treatment of bacterial infections | 拜欧蒂姆公司 | 2018-01-12 | — | — | CN | disclosed |
| CN-107141293-A | Nitrogen-containing heterocyclic compound, preparation method, intermediate, composition and application | 上海医药集团股份有限公司 | 2017-09-08 | — | — | CN | disclosed |
| WO-2011049223-A1 | COMPOSITION AND METHOD FOR CONTROLLING ARTHROPOD PESTS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2011-04-28 | — | — | WO | disclosed |
| EP-1743900-B1 | Organic compounds, organometallic complexes, organic electroluminescent display devices using the complexes and method for preparation of the devices | SAMSUNG SDI CO LTD (KR) | 2008-08-13 | — | — | EP | disclosed |