⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13624519 | 0.78 | — | — | |
| SCHEMBL22664724 | 0.78 | — | — | |
| SCHEMBL14671677 | 0.72 | ADH1B (0.31) | — | |
| SCHEMBL8007666 | 0.69 | — | — | |
| SCHEMBL8173264 | 0.69 | — | — | |
| SCHEMBL20057075 | 0.67 | ADH1B (0.38) | — | |
| SCHEMBL22294571 | 0.65 | — | — | |
| SCHEMBL19792366 | 0.65 | — | — | |
| SCHEMBL13004832 | 0.65 | — | — | |
| SCHEMBL21129320 | 0.65 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2008143729-A2 | MACROLIDE COMPOUNDS AND METHODS OF MAKING AND USING THE SAME | RIB-X PHARMACEUTICALS, INC. (US) | 2008-11-27 | — | — | WO | disclosed |