⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28151489 | 0.71 | — | — | |
| SCHEMBL14616059 | 0.65 | TSHR (0.46) | — | |
| SCHEMBL20176823 | 0.63 | POLB (0.46) | — | |
| SCHEMBL17233963 | 0.62 | — | — | |
| SCHEMBL27674200 | 0.59 | — | — | |
| SCHEMBL28005854 | 0.59 | — | — | |
| SCHEMBL17233960 | 0.59 | — | — | |
| SCHEMBL28125101 | 0.58 | — | — | |
| SCHEMBL14616122 | 0.57 | TSHR (0.46) | — | |
| SCHEMBL9999337 | 0.55 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1309565-B1 | HETEROCYCLIC MUTILIN ESTERS AND THEIR USE AS ANTIBACTERIALS | SMITHKLINE BEECHAM PLC (GB) | 2008-04-09 | — | — | EP | disclosed |