⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8215570 | 0.56 | — | — | |
| Tert-Butylbenzene SCHEMBL21925696 | 0.52 | — | — | |
| SCHEMBL28090128 | 0.47 | — | — | |
| SCHEMBL424728 | 0.45 | TSHR (0.73) | — | |
| SCHEMBL27875587 | 0.44 | — | — | |
| SCHEMBL22538 | 0.41 | — | — | |
| SCHEMBL6775241 | 0.41 | — | — | |
| SCHEMBL830743 | 0.41 | — | — | |
| SCHEMBL6230396 | 0.41 | — | — | |
| SCHEMBL1013573 | 0.41 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-1196716-C | Modified particle, support, catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer | SUMITOMO CHEMICAL CO (JP) | 2005-04-13 | — | — | CN | disclosed |
| CN-1422286-A | Modified particle, support, catalyst component for addition polymerization, catalyst for addition polymerization, and process for producing addition polymer | SUMITOMO CHEMICAL CO (JP) | 2003-06-04 | — | — | CN | disclosed |
| CN-1339040-A | Catalyst for stereoregular polymerization of 2-olefin and process for producing stereoregular-olefin polymer | SUMITOMO CHEMICAL CO (JP) | 2002-03-06 | — | — | CN | disclosed |