⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20776323 | 0.86 | — | — | |
| SCHEMBL5494425 | 0.79 | — | — | |
| SCHEMBL22084028 | 0.79 | — | — | |
| SCHEMBL7793301 | 0.75 | KDM1A (0.31) | — | |
| SCHEMBL20776208 | 0.68 | FUCA1 (0.30) | — | |
| SCHEMBL18225836 | 0.67 | — | — | |
| SCHEMBL20776215 | 0.67 | FUCA1 (0.33) | — | |
| SCHEMBL22249331 | 0.65 | — | — | |
| SCHEMBL22249332 | 0.65 | — | — | |
| SCHEMBL24279827 | 0.65 | KDM1A (0.31) | — |
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-2019046126-A1 | AMINOGLYCOSIDES AND USES THEREOF | ACHAOGEN, INC. (US) | 2019-03-07 | — | — | WO | disclosed |