⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1539714 | 0.95 | — | — | |
| SCHEMBL28693358 | 0.93 | — | — | |
| SCHEMBL27988022 | 0.93 | — | — | |
| SCHEMBL1052803 | 0.93 | NOS3 (0.31) | — | |
| SCHEMBL27987685 | 0.93 | — | — | |
| SCHEMBL28216719 | 0.91 | NOS3 (0.30) | — | |
| SCHEMBL16393757 | 0.90 | — | — | |
| SCHEMBL27330642 | 0.85 | — | — | |
| SCHEMBL4537047 | 0.84 | — | — | |
| SCHEMBL1054226 | 0.84 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-110483670-A | The method of metallocene complex and production olefin polymer | JAPAN POLYPROPYLENE CORP | 2019-11-22 | — | — | CN | disclosed |
| CN-106132975-B | Metallocene complex and process for producing olefin polymer | 日本聚丙烯株式会社 | 2019-11-08 | — | — | CN | disclosed |