⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7144650 | 0.90 | TLR4 (0.31) | — | |
| SCHEMBL7136453 | 0.89 | L3MBTL1 (0.31) | — | |
| SCHEMBL9786196 | 0.86 | TLR4 (0.33) | — | |
| SCHEMBL7526203 | 0.84 | — | — | |
| SCHEMBL7137825 | 0.84 | — | — | |
| SCHEMBL7137280 | 0.83 | TLR4 (0.35) | — | |
| SCHEMBL7137272 | 0.83 | TLR4 (0.35) | — | |
| SCHEMBL7141796 | 0.81 | TLR4 (0.32) | — | |
| SCHEMBL7141794 | 0.80 | TLR4 (0.35) | — | |
| SCHEMBL7136893 | 0.80 | SLC5A1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6511965-B2 | For therapy and prophylaxis of inflammatory disorders, autoimmune diseases or septicemia | SANKYO COMPANY, LIMITED (JP) | 2003-01-28 | — | — | US | disclosed |
| US-20020161221-A1 | Ether type lipid a 1-carboxylic acid analogs | SANKYO COMPANY, LIMITED (JP) | 2002-10-31 | — | — | US | disclosed |
| US-6440956-B1 | Bicyclic polyaminoacid metal complexes, their process of preparation and their application in medical imaging | GUERBET (FR) | 2002-08-27 | — | — | US | disclosed |
| EP-1186305-A1 | New brominated compounds as contrast media for X-ray mammography | Schering Aktiengesellschaft (DE) | 2002-03-13 | — | — | EP | disclosed |
| EP-1152007-A1 | ETHER TYPE LIPID A1-CARBOXYLIC ACID ANALOGUES | Sankyo Company, Limited (JP) | 2001-11-07 | — | — | EP | disclosed |
| US-6187285-B1 | IN PARTICULAR MAGNETIC RESONANCE IMAGING (MRI) FOR MAGNETIC CATIONS. | GUERBET (FR) | 2001-02-13 | — | — | US | disclosed |