⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28041212 | 0.87 | — | — | |
| SCHEMBL28041360 | 0.84 | EDNRB (0.32) | — | |
| SCHEMBL27978443 | 0.83 | CHRNB2 (0.33) | — | |
| SCHEMBL28041213 | 0.80 | BRD4 (0.34) | — | |
| SCHEMBL28041264 | 0.80 | BRD4 (0.34) | — | |
| SCHEMBL28041170 | 0.80 | HRH3 (0.36) | — | |
| SCHEMBL15867150 | 0.77 | PTAFR (0.30) | — | |
| SCHEMBL17415342 | 0.75 | — | — | |
| SCHEMBL15867151 | 0.74 | — | — | |
| SCHEMBL18124398 | 0.73 | RXRA (0.33) | — |
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-105026408-B | Metallocene compound, olefin polymer catalyst, the manufacturing method of olefin polymer and olefin polymer | 日本聚乙烯株式会社 | 2018-09-11 | — | — | CN | disclosed |
| CN-105026408-A | Metallocene compound, catalyst for olefin polymer, method for producing olefin polymer, and olefin polymer | JAPAN POLYETHYLENE CORP | 2015-11-04 | — | — | CN | disclosed |