⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL7067486 | 0.79 | — | — | |
| SCHEMBL7934073 | 0.70 | CYP11B2 (0.31) | — | |
| SCHEMBL17337847 | 0.66 | — | — | |
| SCHEMBL15914866 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL6906852 | 0.64 | — | — | |
| SCHEMBL15915391 | 0.64 | CYP11B2 (0.31) | — | |
| SCHEMBL8777529 | 0.64 | — | — | |
| SCHEMBL8083724 | 0.64 | — | — | |
| SCHEMBL918424 | 0.63 | — | — | |
| Bromide SCHEMBL16424549 | 0.63 | — | — |
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-20030207757-A1 | Catalyst composition comprising metallocene compound having bulky cycloalkyl-substituted cyclopentadienyl ligand, and process for olefin polymerization using the same | DAELIM INDUSTRIES CO., LTD. (KR) | 2003-11-06 | — | — | US | disclosed |