⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2493267 | 0.92 | — | — | |
| SCHEMBL2491422 | 0.90 | ALDH1A1 (0.33) | — | |
| SCHEMBL8949614 | 0.83 | — | — | |
| SCHEMBL63508 | 0.78 | — | — | |
| SCHEMBL6141195 | 0.74 | — | — | |
| SCHEMBL170322 | 0.72 | — | — | |
| SCHEMBL9422568 | 0.72 | — | — | |
| SCHEMBL36631 | 0.70 | — | — | |
| SCHEMBL28785992 | 0.70 | TSHR (0.32) | — | |
| SCHEMBL8592154 | 0.70 | TSHR (0.42) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2552989-A1 | PREPARATION OF LIGNOCELLULOSIC PRODUCTS | Dow Corning Corporation (US) | 2013-02-06 | — | — | EP | claimed |
| US-20130022807-A1 | Preparation Of Lignocellulosic Products | DOW SILICONES CORPORATION | 2013-01-24 | — | — | US | claimed |
| WO-2011119990-A1 | PREPARATION OF LIGNOCELLULOSIC PRODUCTS | DOW CORNING CORPORATION (US) | 2011-09-29 | — | — | WO | claimed |
| US-8907037-B2 | Preparation of lignocellulosic products | DOW CORNING CORPORATION (US) | 2014-12-09 | — | — | US | disclosed |
| EP-2552989-A1 | PREPARATION OF LIGNOCELLULOSIC PRODUCTS | Dow Corning Corporation (US) | 2013-02-06 | — | — | EP | disclosed |
| US-20130022807-A1 | Preparation Of Lignocellulosic Products | DOW SILICONES CORPORATION | 2013-01-24 | — | — | US | disclosed |
| WO-2011119990-A1 | PREPARATION OF LIGNOCELLULOSIC PRODUCTS | DOW CORNING CORPORATION (US) | 2011-09-29 | — | — | WO | disclosed |