⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL699216 | 0.81 | — | — | |
| SCHEMBL10627363 | 0.74 | CYP2C19 (0.31) | — | |
| SCHEMBL4446924 | 0.74 | CYP2C19 (0.31) | — | |
| Trimethylammonium SCHEMBL27513041 | 0.73 | — | — | |
| SCHEMBL6676094 | 0.67 | — | — | |
| SCHEMBL6238266 | 0.66 | CYP2C19 (0.36) | — | |
| SCHEMBL4446921 | 0.65 | CYP2C19 (0.38) | — | |
| SCHEMBL2960180 | 0.64 | CYP2C19 (0.35) | — | |
| SCHEMBL28295599 | 0.63 | — | — | |
| SCHEMBL32671413 | 0.63 | CYP2C19 (0.32) | — |
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-103189396-B | The manufacture method of solid catalyst component for olefin polymerization, polymerization of olefines catalyst and olefin polymer | 东邦钛株式会社 | 2016-06-29 | — | — | CN | disclosed |
| CN-104640885-A | Solid catalyst component for polymerization of olefins, catalyst for polymerization of olefins, and method for producing olefin polymer | TOHO TITANIUM CO LTD | 2015-05-20 | — | — | CN | disclosed |
| CN-103189396-A | Method for producing solid catalyst component for olefin polymerization, catalyst for olefin polymerization, and olefin polymers | TOHO TITANIUM CO LTD | 2013-07-03 | — | — | CN | disclosed |