⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL15484139 | 0.71 | — | — | |
| SCHEMBL12780704 | 0.71 | — | — | |
| SCHEMBL22079744 | 0.65 | — | — | |
| SCHEMBL14754529 | 0.64 | — | — | |
| SCHEMBL22198849 | 0.61 | — | — | |
| SCHEMBL5587493 | 0.58 | ALDH1A1 (0.35) | — | |
| SCHEMBL7020930 | 0.58 | — | — | |
| SCHEMBL4400936 | 0.58 | — | — | |
| SCHEMBL6865275 | 0.55 | — | — | |
| SCHEMBL4384992 | 0.54 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1673321-B9 | METHOD OF PREPARING FULVENE COMPOUNDS AND METHOD OF PREPARING ANSA-METALLOCENE COMPOUNDS USING THE COMPOUNDS | LG CHEMICAL LTD (KR) | 2015-04-22 | — | — | EP | disclosed |
| EP-1673321-B1 | METHOD OF PREPARING FULVENE COMPOUNDS AND METHOD OF PREPARING ANSA-METALLOCENE COMPOUNDS USING THE COMPOUNDS | LG CHEMICAL LTD (KR) | 2014-09-17 | — | — | EP | disclosed |
| US-7166731-B2 | Method of preparing fulvene compounds and method of preparing ansa-metallocene compounds using the compounds | LG CHEM. LTD. (KR) | 2007-01-23 | — | — | US | disclosed |
| EP-1673321-A1 | METHOD OF PREPARING FULVENE COMPOUNDS AND METHOD OF PREPARING ANSA-METALLOCENE COMPOUNDS USING THE COMPOUNDS | LG Chem, Ltd. (KR) | 2006-06-28 | — | — | EP | disclosed |
| WO-2005035470-A1 | METHOD OF PREPARING FULVENE COMPOUNDS AND METHOD OF PREPARING ANSA-METALLOCENE COMPOUNDS USING THE COMPOUNDS | LG CHEM. LTD. (KR) | 2005-04-21 | — | — | WO | disclosed |
| US-20050080296-A1 | Method of preparing fulvene compounds and method of preparing ansa-metallocene compounds using the compounds | LG CHEM. LTD. (KR) | 2005-04-14 | — | — | US | disclosed |