⚠ 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 SCHEMBL7181058 | 0.67 | — | — | |
| Chloromethane SCHEMBL818260 | 0.65 | — | — | |
| SCHEMBL820172 | 0.64 | — | — | |
| SCHEMBL4480097 | 0.64 | — | — | |
| SCHEMBL6989170 | 0.63 | — | — | |
| Hypochlorous Acid SCHEMBL9161961 | 0.63 | — | — | |
| SCHEMBL2043745 | 0.63 | — | — | |
| Chloromethane SCHEMBL9860929 | 0.63 | — | — | |
| Hydrochloric Acid SCHEMBL597368 | 0.62 | — | — | |
| Ethane SCHEMBL9168230 | 0.62 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6583304-B2 | Coordination catalyst | DAELIM INDUSTRIAL CO., LTD. (KR) | 2003-06-24 | — | — | US | disclosed |
| US-20010025117-A1 | Metallocene compounds, metallocene catalysts including the compounds and methods of polymerizing olefins with the catalysts | DL CHEMICAL CO., LTD. (KR) | 2001-09-27 | — | — | US | disclosed |