⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1257021 | 0.77 | OR51E2 (0.59) | — | |
| SCHEMBL93977 | 0.77 | OR51E2 (0.50) | — | |
| SCHEMBL572817 | 0.77 | OR51E2 (0.50) | — | |
| SCHEMBL29611276 | 0.76 | ALDH1A1 (0.46) | — | |
| SCHEMBL7532534 | 0.76 | OR51E2 (0.43) | — | |
| SCHEMBL13788464 | 0.76 | OR51E2 (0.43) | — | |
| SCHEMBL187076 | 0.76 | — | — | |
| SCHEMBL16631788 | 0.76 | OR51E2 (0.43) | — | |
| SCHEMBL8323774 | 0.76 | — | — | |
| SCHEMBL10537213 | 0.76 | — | — |
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-7375168-B2 | Protein compatible methods and compounds for controlling the morphology and shrinkage of silica derived from polyol-modified silanes | MCMASTER UNIVERSITY | 2008-05-20 | — | — | US | disclosed |
| US-20060068407-A1 | Method of immobilizing nucleic acid aptamers | MCMASTER UNIVERSITY (CA) | 2006-03-30 | — | — | US | disclosed |
| WO-2005080592-A1 | METHOD OF IMMOBILIZING NUCLEIC ACID APTAMERS | MCMASTER UNIVERSITY (CA) | 2005-09-01 | — | — | WO | disclosed |
| US-20040249082-A1 | Protein compatible methods and compounds for controlling the morphology and shrinkage of silica derived from polyol-modified silanes | MCMASTER UNIVERSITY (CA) | 2004-12-09 | — | — | US | disclosed |
| EP-0446754-B1 | Glyceroxyfunctional silanes and siloxanes | DOW CORNING (US) | 1993-11-24 | — | — | EP | disclosed |
| EP-0446754-A1 | Glyceroxyfunctional silanes and siloxanes | DOW CORNING CORPORATION (US) | 1991-09-18 | — | — | EP | disclosed |