⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2209108 | 0.82 | — | — | |
| SCHEMBL3955461 | 0.69 | — | — | |
| SCHEMBL9426197 | 0.67 | TSHR (0.32) | — | |
| SCHEMBL30861 | 0.66 | — | — | |
| SCHEMBL3803581 | 0.66 | — | — | |
| SCHEMBL3955987 | 0.65 | — | — | |
| SCHEMBL7191445 | 0.65 | — | — | |
| SCHEMBL7591793 | 0.65 | ALDH1A1 (0.35) | — | |
| SCHEMBL8520920 | 0.64 | — | — | |
| SCHEMBL9265706 | 0.64 | — | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9061903-B2 | Sulfonate modified nanocrystals | Life Technologies Corporation (US) | 2015-06-23 | — | — | US | disclosed |
| US-20110220844-A1 | SULFONATE MODIFIED NANOCRYSTALS | Life Technologies Corporation | 2011-09-15 | — | — | US | disclosed |
| EP-2342161-A2 | SULFONATE MODIFIED NANOCRYSTALS | Life Technologies Corporation (US) | 2011-07-13 | — | — | EP | disclosed |
| WO-2010040111-A2 | SULFONATE MODIFIED NANOCRYSTALS | Life Technologies Corporation (US) | 2010-04-08 | — | — | WO | disclosed |
| WO-2009029062-A1 | PROCESS FOR MAKING A PLANT GROWTH REGULATOR | RHODIA INC. (US) | 2009-03-05 | — | — | WO | disclosed |
| US-20080103046-A1 | Process for making a plant growth regulator | PALMER FRANCINE | 2008-05-01 | — | — | US | disclosed |
| US-6465649-B1 | Methods for the dealkylation of phosphonate esters | GILEAD SCIENCES, INC. | 2002-10-15 | — | — | US | disclosed |