⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20386546 | 0.79 | — | — | |
| SCHEMBL17087209 | 0.77 | — | — | |
| SCHEMBL20662158 | 0.74 | — | — | |
| SCHEMBL13283699 | 0.71 | — | — | |
| SCHEMBL2183 | 0.67 | — | — | |
| SCHEMBL19372809 | 0.67 | — | — | |
| Ethylenediamine SCHEMBL3083 | 0.65 | — | — | |
| Ethylenediamine SCHEMBL37647 | 0.65 | — | — | |
| Ethylenediamine SCHEMBL7085968 | 0.65 | NFKB1 (0.50) | — | |
| Ethylenediamine SCHEMBL28924405 | 0.65 | NFKB1 (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-2331529-B1 | NOVEL OXAZOLIDINONE DERIVATIVES WITH CYCLIC AMIDOXIME OR CYCLIC AMIDRAZONE AND PHARMACEUTICAL COMPOSITIONS THEREOF | LEGOCHEM BIOSCIENCES INC (KR) | 2014-11-05 | — | — | EP | disclosed |