⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8158531 | 0.84 | CA1 (0.35) | — | |
| SCHEMBL819221 | 0.84 | — | — | |
| SCHEMBL819673 | 0.84 | — | — | |
| SCHEMBL7710465 | 0.83 | — | — | |
| SCHEMBL7710084 | 0.82 | — | — | |
| SCHEMBL8168799 | 0.82 | — | — | |
| SCHEMBL8170508 | 0.80 | TRPA1 (0.30) | — | |
| SCHEMBL8165569 | 0.80 | TRPA1 (0.30) | — | |
| SCHEMBL8624050 | 0.77 | — | — | |
| SCHEMBL1703034 | 0.74 | — | — |
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-H2060-H1 | Cyclobutyl silanes for catalysts useful for making highly isotactic olefin polymers | ENGELHARD CORPORATION | 2003-03-04 | — | — | US | claimed |
| US-H2060-H1 | Cyclobutyl silanes for catalysts useful for making highly isotactic olefin polymers | ENGELHARD CORPORATION | 2003-03-04 | — | — | US | disclosed |
| US-6362124-B1 | INCLUDING ORGANOSILICON COMPOUND IN A COORDINATION CATALYST WHICH ALSO CONTAINS; ORGANOMAGNESIUM, ORGANOALUMINUM AND TITANIUM COMPOUNDS; SUPERIOR POLYMERIZATION ACTIVITY AND STEREOSPECIFIC EFFICIENCY. | SUMITOMO CHEMICAL CO., LTD. (JP) | 2002-03-26 | — | — | US | disclosed |