⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL812577 | 0.71 | CTSD (0.35) | — | |
| Hydrochloric Acid SCHEMBL7756684 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL4633025 | 0.70 | — | — | |
| Fluoride SCHEMBL27948615 | 0.69 | CTSD (0.33) | — | |
| Hydrochloric Acid SCHEMBL710942 | 0.69 | CTSD (0.33) | — | |
| Hydrochloric Acid SCHEMBL27553871 | 0.69 | CTSD (0.33) | — | |
| Bromide SCHEMBL1539586 | 0.69 | CTSD (0.33) | — | |
| Hydrochloric Acid SCHEMBL149638 | 0.69 | CTSD (0.33) | — | |
| Iodide SCHEMBL27948708 | 0.69 | CTSD (0.33) | — | |
| Fluoride SCHEMBL1131348 | 0.69 | CTSD (0.33) | — |
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-6214954-B1 | HOMO OR COPOLYMERIZING AN OLEFIN WITH POLYMERIZATION CATALYST COMPRISING A TRANSITION METAL COMPOUND, CYCLOPENTADIENYL RING CONTAINING LIGAND AND A CHELATING LIGAND, PRODUCES POLYMER WITH NARROW MOLECULAR WEIGHT DISTRIBUTION AND UNIFORMITY | ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) | 2001-04-10 | — | — | US | disclosed |
| EP-0798313-B1 | OLEFIN POLYMERIZATION CATALYST | ASAHI CHEMICAL IND (JP) | 2001-03-21 | — | — | EP | disclosed |
| EP-0798313-A1 | OLEFIN POLYMERIZATION CATALYST | Asahi Kasei Kogyo Kabushiki Kaisha (JP) | 1997-10-01 | — | — | EP | disclosed |