⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13293892 | 0.81 | — | — | |
| Hydrochloric Acid SCHEMBL2185322 | 0.80 | — | — | |
| SCHEMBL13293907 | 0.61 | — | — | |
| Hydrochloric Acid SCHEMBL2185787 | 0.60 | IRAK4 (0.31) | — | |
| SCHEMBL1685186 | 0.57 | — | — | |
| SCHEMBL15698517 | 0.53 | MAPT (0.31) | — | |
| SCHEMBL15698520 | 0.52 | — | — | |
| SCHEMBL20175890 | 0.50 | — | — | |
| SCHEMBL4528077 | 0.50 | — | — | |
| SCHEMBL25787690 | 0.50 | — | — |
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-2341777-B1 | ANTIMICROBIAL OXAZOLIDINONE, HYDANTOIN AND IMIDAZOLIDINONE COMPOSITIONS | NOVABAY PHARMACEUTICALS INC (US) | 2015-01-21 | — | — | EP | disclosed |