⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL91888 | 0.71 | — | — | |
| SCHEMBL10758780 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL27923435 | 0.67 | — | — | |
| Methylhydrazine SCHEMBL3103 | 0.59 | — | — | |
| Methylhydrazine SCHEMBL3175579 | 0.59 | — | — | |
| SCHEMBL16644622 | 0.58 | — | — | |
| SCHEMBL14468823 | 0.58 | — | — | |
| SCHEMBL17553380 | 0.58 | — | — | |
| SCHEMBL5049803 | 0.58 | — | — | |
| SCHEMBL22071194 | 0.56 | — | — |
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-2164325-B1 | OXYIMINO COMPOUNDS AND THE USE THEREOF | SHIONOGI & CO (JP) | 2013-04-24 | — | — | EP | disclosed |