⚠ 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 | |
|---|---|---|---|---|
| Epetraborole SCHEMBL31673512 | 0.96 | — | — | |
| Epetraborole SCHEMBL3446407 | 0.96 | — | — | |
| Epetraborole SCHEMBL1498692 | 0.96 | — | — | |
| Epetraborole SCHEMBL1895215 | 0.96 | — | — | |
| Epetraborole SCHEMBL29378846 | 0.96 | — | — | |
| Epetraborole SCHEMBL3447124 | 0.95 | — | — | |
| Epetraborole SCHEMBL1980656 | 0.95 | — | — | |
| Acetic Acid SCHEMBL3446626 | 0.93 | — | — | |
| SCHEMBL3643377 | 0.91 | — | — | |
| Hydrochloric Acid SCHEMBL3446337 | 0.90 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2164331-A1 | BORON-CONTAINING SMALL MOLECULES | Anacor Pharmaceuticals, Inc. (US) | 2010-03-24 | — | — | EP | disclosed |
| WO-2008157726-A1 | BORON-CONTAINING SMALL MOLECULES | ANACOR PHARMACEUTICALS, INC. (US) | 2008-12-24 | — | — | WO | disclosed |