⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18797774 | 1.00 | — | — | |
| SCHEMBL20789107 | 1.00 | — | — | |
| SCHEMBL18815485 | 0.85 | — | — | |
| SCHEMBL18797834 | 0.85 | — | — | |
| SCHEMBL20789111 | 0.85 | — | — | |
| SCHEMBL18797811 | 0.85 | — | — | |
| SCHEMBL18797812 | 0.85 | — | — | |
| SCHEMBL18797833 | 0.85 | — | — | |
| SCHEMBL20805189 | 0.79 | — | — | |
| SCHEMBL18815479 | 0.79 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20190077797-A1 | PROCESSES FOR PREPARING 2-DIHALO RIBOLACTONES | EMORY UNIVERSITY | 2019-03-14 | — | — | US | disclosed |
| WO-2017075590-A2 | PROCESSES FOR PREPARING 2-DIHALO RIBOLACTONES | COCRYSTAL PHARMA, INC. (US) | 2017-05-04 | — | — | WO | disclosed |