⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3837700 | 0.82 | — | — | |
| SCHEMBL7038556 | 0.71 | CYP3A4 (0.40) | — | |
| SCHEMBL2581786 | 0.70 | — | — | |
| SCHEMBL21722359 | 0.67 | PDCD1 (0.37) | — | |
| SCHEMBL21936342 | 0.67 | TSHR (0.35) | — | |
| SCHEMBL148575 | 0.67 | TSHR (0.35) | — | |
| SCHEMBL4144518 | 0.66 | CYP2A6 (0.38) | — | |
| SCHEMBL29638145 | 0.66 | CYP2A6 (0.38) | — | |
| SCHEMBL9787307 | 0.66 | — | — | |
| SCHEMBL5613500 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7279537-B2 | Transition metal complexes and polymerization catalysts | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2007-10-09 | — | — | US | disclosed |
| US-20060229195-A1 | Transition metal complexes and polymerization catalysts | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2006-10-12 | — | — | US | disclosed |
| EP-1557423-A1 | TRANSITION METAL COMPLEXES AND POLYMERIZATION CATALYSTS | Sumitomo Chemical Company, Limited (JP) | 2005-07-27 | — | — | EP | disclosed |