⚠ 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 | |
|---|---|---|---|---|
| Malonic Acid SCHEMBL431222 | 0.95 | — | — | |
| Malonic Acid SCHEMBL333874 | 0.95 | — | — | |
| Malonic Acid SCHEMBL957648 | 0.91 | LDHA (0.82) | — | |
| Malonic Acid SCHEMBL22466327 | 0.91 | — | — | |
| Malonic Acid SCHEMBL4365586 | 0.91 | LDHA (0.82) | — | |
| Malonic Acid SCHEMBL11748324 | 0.91 | — | — | |
| Malonic Acid SCHEMBL1332554 | 0.91 | — | — | |
| Malonic Acid SCHEMBL1332405 | 0.91 | — | — | |
| Malonic Acid SCHEMBL336 | 0.91 | — | — | |
| Malonic Acid SCHEMBL3358611 | 0.91 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1993569-B1 | ANTI-AGING TREATMENT USING COPPER AND ZINC COMPOSITIONS | OMP INC (US) | 2014-07-23 | — | — | EP | claimed |
| CN-111615385-B | Compositions and methods for treating emphysema and other forms of COPD | 肺气肿解决方案私人有限公司 | 2023-07-14 | — | — | CN | disclosed |
| CN-111615385-A | Compositions and methods for treating emphysema and other forms of COPD | 肺气肿解决方案私人有限公司 | 2020-09-01 | — | — | CN | disclosed |
| US-8952057-B2 | Compositions for anorectal use and methods for treating anorectal disorders | JR CHEM, LLC (US) | 2015-02-10 | — | — | US | disclosed |
| US-20120177583-A1 | COMPOSITIONS FOR ANORECTAL USE AND METHODS FOR TREATING ANORECTAL DISORDERS | JR CHEM, LLC | 2012-07-12 | — | — | US | disclosed |