⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17213228 | 0.66 | — | — | |
| SCHEMBL27457128 | 0.63 | — | — | |
| SCHEMBL15711053 | 0.62 | — | — | |
| SCHEMBL7734591 | 0.62 | ALDH1A1 (0.39) | — | |
| SCHEMBL14331560 | 0.60 | — | — | |
| SCHEMBL25330082 | 0.60 | — | — | |
| SCHEMBL8996645 | 0.60 | — | — | |
| SCHEMBL17479965 | 0.60 | — | — | |
| SCHEMBL5314714 | 0.60 | — | — | |
| SCHEMBL459480 | 0.60 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20100222622-A1 | Oligomerisation of Olefinic Compounds in the Presence of a Diluted Metal Containing Activator | SASOL TECHNOLOGY (PTY) LIMITED (ZA) | 2010-09-02 | — | — | US | disclosed |