⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7700671 | 0.77 | PTGS1 (0.40) | — | |
| SCHEMBL16859749 | 0.77 | — | — | |
| SCHEMBL1003883 | 0.74 | — | — | |
| SCHEMBL1003884 | 0.74 | — | — | |
| SCHEMBL1234847 | 0.72 | — | — | |
| SCHEMBL20670 | 0.72 | — | — | |
| SCHEMBL11668132 | 0.69 | — | — | |
| Hydrochloric Acid SCHEMBL310744 | 0.69 | — | — | |
| Ethylene SCHEMBL20544036 | 0.69 | — | — | |
| Fluoride SCHEMBL15259556 | 0.69 | — | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1472291-B1 | ORGANIC-INORGANIC NANOCOMPOSITE AND PREPARATION THEREOF | LG CHEMICAL LTD (KR) | 2008-09-17 | — | — | EP | disclosed |
| US-7115683-B2 | Polymerizing monomers in the presence of an emulsifier and a layered silicate salt ion-exchanged with a cationic initiator and a dithiocarboxylate cationic chain transfer agent having a quaternary ammonium group | LG CHEM, LTD. (KR) | 2006-10-03 | — | — | US | disclosed |
| US-20040259998-A1 | Adding monomers, an initiator, and an emulsifier to an ion-exchanged layered silicate salt that is prepared by adding a cationic initiator and a cationic chain transfer agent to a layered silicate compound to cause polymerization | LG CHEM, LTD. (KR) | 2004-12-23 | — | — | US | disclosed |
| EP-1472291-A1 | ORGANIC-INORGANIC NANOCOMPOSITE AND PREPARATION THEREOF | LG Chem, Ltd. (KR) | 2004-11-03 | — | — | EP | disclosed |
| WO-2003066686-A1 | ORGANIC-INORGANIC NANOCOMPOSITE AND PREPARATION THEREOF | LG CHEM, LTD. (KR) | 2003-08-14 | — | — | WO | disclosed |