⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2622744 | 0.95 | — | — | |
| SCHEMBL7212176 | 0.73 | ALDH1A1 (0.31) | — | |
| Tert-Butanol SCHEMBL16552604 | 0.68 | — | — | |
| SCHEMBL620354 | 0.67 | — | — | |
| SCHEMBL620424 | 0.67 | THRB (0.35) | — | |
| SCHEMBL6745244 | 0.67 | THRB (0.43) | — | |
| SCHEMBL10694715 | 0.67 | — | — | |
| SCHEMBL4585840 | 0.67 | — | — | |
| SCHEMBL28710512 | 0.64 | — | — | |
| SCHEMBL263794 | 0.64 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-110536910-A | Contain Low-valent Titanium-aluminium complex antigravity system and the polymer produced by it | CHEVRON PHILLIPS CHEMICAL CO LP | 2019-12-03 | — | — | CN | disclosed |
| CN-108026220-A | Heterogeneous Ziegler-Natta catalyst with fluorinated silica-coated alumina | 切弗朗菲利浦化学公司 | 2018-05-11 | — | — | CN | disclosed |
| CN-107922539-A | The heterogeneous Ziegler Natta catalyst of the aluminium oxide through coated with silica with fluorination | 切弗朗菲利浦化学公司 | 2018-04-17 | — | — | CN | disclosed |
| CN-107922540-A | Ziegler-Natta (ZIEG L ER-NATTA) -metallocene dual catalyst system with activator-support | 切弗朗菲利浦化学公司 | 2018-04-17 | — | — | CN | disclosed |