⚠ 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 | |
|---|---|---|---|---|
| Methyl Alcohol SCHEMBL9569297 | 0.96 | NLRP3 (0.36) | — | |
| SCHEMBL6336930 | 0.77 | NLRP3 (0.59) | — | |
| SCHEMBL6337951 | 0.77 | NLRP3 (0.59) | — | |
| SCHEMBL981332 | 0.76 | — | — | |
| SCHEMBL17904315 | 0.76 | — | — | |
| SCHEMBL18181596 | 0.76 | — | — | |
| SCHEMBL18850787 | 0.75 | PDCD4 (0.43) | — | |
| SCHEMBL12150952 | 0.74 | DUT (0.43) | — | |
| SCHEMBL16925986 | 0.74 | NLRP3 (0.33) | — | |
| SCHEMBL6338491 | 0.74 | DUT (0.43) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20110269707-A1 | Modified nucleosides for the treatment of viral infections and abnormal cellullar proliferation | PHARMASSET, INC. | 2011-11-03 | — | — | US | disclosed |
| US-20110014504-A1 | LITHIUM SECONDARY BATTERY | MITSUBISHI CHEMICAL CORPORATION (JP) | 2011-01-20 | — | — | US | disclosed |
| US-20080311478-A1 | Lithium Secondary Battery | MITSUBISHI CHEMICAL CORPORATION (JP) | 2008-12-18 | — | — | US | disclosed |
| EP-1892789-A1 | LITHIUM SECONDARY BATTERY | Mitsubishi Chemical Corporation (JP) | 2008-02-27 | — | — | EP | disclosed |