⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL8379033 | 1.00 | — | — | |
| Hydrochloric Acid SCHEMBL713979 | 0.95 | — | — | |
| SCHEMBL8736461 | 0.82 | — | — | |
| SCHEMBL6346381 | 0.80 | — | — | |
| Hydrochloric Acid SCHEMBL4467308 | 0.78 | — | — | |
| SCHEMBL8765795 | 0.76 | — | — | |
| SCHEMBL9400778 | 0.76 | — | — | |
| Hydrochloric Acid SCHEMBL720056 | 0.72 | — | — | |
| SCHEMBL8715462 | 0.72 | — | — | |
| SCHEMBL6055264 | 0.72 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-5916982-A | Process for the production of polyolefins | NIPPON OIL CO., LTD. (JP) | 1999-06-29 | — | — | US | disclosed |
| EP-0768320-A1 | Catalyst component and catalyst | NIPPON OIL CO. LTD. (JP) | 1997-04-16 | — | — | EP | disclosed |
| EP-0768319-A1 | Process for the production of polyolefins | NIPPON OIL CO. LTD. (JP) | 1997-04-16 | — | — | EP | disclosed |