⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14722986 | 0.75 | TBXAS1 (0.52) | — | |
| SCHEMBL32660138 | 0.75 | TBXAS1 (0.52) | — | |
| SCHEMBL16371567 | 0.71 | TBXAS1 (0.48) | — | |
| SCHEMBL83887 | 0.71 | — | — | |
| SCHEMBL20034172 | 0.71 | — | — | |
| SCHEMBL22849646 | 0.71 | — | — | |
| SCHEMBL22024524 | 0.71 | ALDH1A1 (0.44) | — | |
| SCHEMBL16101936 | 0.70 | — | — | |
| SCHEMBL16101937 | 0.70 | — | — | |
| Hydrochloric Acid SCHEMBL252185 | 0.70 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2019182986-A1 | PROCESS FOR FUNCTIONALIZATION OF ORGANO-METAL COMPOUNDS WITH SILYL-BASED FUNCTIONALIZATION AGENTS AND SILYL-FUNCTIONALIZED COMPOUNDS PREPARED THEREBY | DOW GLOBAL TECHNOLOGIES LLC (US) | 2019-09-26 | — | — | WO | disclosed |
| WO-2019182993-A1 | SILICON-TERMINATED TELECHELIC POLYOLEFIN COMPOSITIONS AND PROCESSES FOR PREPARING THE SAME | DOW GLOBAL TECHNOLOGIES LLC (US) | 2019-09-26 | — | — | WO | disclosed |