⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7934073 | 0.67 | CYP11B2 (0.31) | — | |
| Iodide SCHEMBL27933287 | 0.64 | CYP11B2 (0.33) | — | |
| Hydrochloric Acid SCHEMBL27948703 | 0.64 | CYP11B2 (0.33) | — | |
| Bromide SCHEMBL27948716 | 0.64 | CYP11B2 (0.33) | — | |
| SCHEMBL7073906 | 0.64 | — | — | |
| SCHEMBL7197535 | 0.62 | — | — | |
| Fluoride SCHEMBL28809045 | 0.62 | CYP11B2 (0.31) | — | |
| Bromide SCHEMBL27948685 | 0.62 | CYP11B2 (0.31) | — | |
| SCHEMBL15915391 | 0.62 | CYP11B2 (0.31) | — | |
| SCHEMBL8424670 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1035138-A1 | SOLID CATALYSTS FOR THE POLYMERIZATION OF OLEFINS AND PROCESS FOR THE PRODUCTION OF OLEFIN POLYMERS THEREWITH | MARUZEN PETROCHEMICAL CO., LTD. (JP) | 2000-09-13 | — | — | EP | disclosed |