⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6250953 | 0.74 | — | — | |
| Hydrochloric Acid SCHEMBL22492248 | 0.72 | — | — | |
| SCHEMBL6249317 | 0.71 | — | — | |
| SCHEMBL6248763 | 0.71 | — | — | |
| SCHEMBL8146576 | 0.71 | — | — | |
| SCHEMBL6247916 | 0.69 | — | — | |
| SCHEMBL8031727 | 0.66 | — | — | |
| SCHEMBL8146578 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL6344123 | 0.65 | — | — | |
| SCHEMBL6353762 | 0.65 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0671416-B1 | Transition metal compound, polymerization catalyst comprising the same and process for producing styrenic polymer using said polymerization catalyst | IDEMITSU KOSAN CO (JP) | 2005-08-31 | — | — | EP | disclosed |
| US-RE36563-E | Transition metal compound, polymerization catalyst using same and process for producing styrenic polymer using said polymerization catalyst | IDEMITSU KOSAN CO., LTD. (JP) | 2000-02-08 | — | — | US | disclosed |
| US-5596054-A | COORDINATION CATALYSTS FOR ADDITION POLYMERIZATION | IDEMITSU KOSAN CO., LTD. (JP) | 1997-01-21 | — | — | US | disclosed |
| EP-0671416-A1 | Transition metal compound, polymerization catalyst comprising the same and process for producing styrenic polymer using said polymerization catalyst | IDEMITSU KOSAN COMPANY LIMITED (JP) | 1995-09-13 | — | — | EP | disclosed |