⚠ 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 | |
|---|---|---|---|---|
| Methane SCHEMBL11570140 | 0.95 | — | — | |
| SCHEMBL9614403 | 0.94 | HIF1A (0.56) | — | |
| SCHEMBL26047 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL456275 | 0.89 | — | — | |
| SCHEMBL4733483 | 0.89 | — | — | |
| SCHEMBL5616852 | 0.89 | HIF1A (0.50) | — | |
| Methane SCHEMBL18191054 | 0.89 | HIF1A (0.50) | — | |
| SCHEMBL13671434 | 0.89 | HIF1A (0.67) | — | |
| Piperazine SCHEMBL22158351 | 0.89 | HIF1A (0.67) | — | |
| SCHEMBL4273750 | 0.89 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0743574-B1 | Migration imaging members | XEROX CORP (US) | 2000-12-27 | — | — | EP | claimed |
| EP-0743573-B1 | Method for obtaining image contrast migration imaging members | XEROX CORP (US) | 2000-09-06 | — | — | EP | claimed |