⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7782660 | 0.95 | — | — | |
| SCHEMBL284772 | 0.95 | — | — | |
| Methane SCHEMBL2195650 | 0.91 | — | — | |
| Ammonia Solution, Strong SCHEMBL3814953 | 0.91 | — | — | |
| Ethane SCHEMBL9517048 | 0.91 | — | — | |
| Propane SCHEMBL9442322 | 0.84 | — | — | |
| Thiosulfuric Acid SCHEMBL15284422 | 0.82 | CA2 (0.47) | — | |
| SCHEMBL5417020 | 0.81 | PTGS1 (0.33) | — | |
| Hydrogen Sulfide SCHEMBL4991298 | 0.80 | — | — | |
| Thiosulfuric Acid SCHEMBL9560201 | 0.80 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11396672-B2 | Composition and methods for detecting adenosine modifications | THE UNIVERSITY OF CHICAGO (US) | 2022-07-26 | — | — | US | disclosed |
| US-20180245128-A1 | COMPOSITION AND METHODS FOR DETECTING ADENOSINE MODIFICATIONS | THE UNIVERSITY OF CHICAGO (US) | 2018-08-30 | — | — | US | disclosed |
| WO-2017040477-A1 | COMPOSITION AND METHODS FOR DETECTING ADENOSINE MODIFICATIONS | THE UNIVERSITY OF CHICAGO (US) | 2017-03-09 | — | — | WO | disclosed |