⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6048333 | 0.87 | — | — | |
| SCHEMBL19549661 | 0.87 | NPC1 (0.35) | — | |
| SCHEMBL429135 | 0.83 | — | — | |
| SCHEMBL2519060 | 0.81 | ALDH1A1 (0.31) | — | |
| SCHEMBL23215236 | 0.78 | — | — | |
| SCHEMBL21382383 | 0.76 | — | — | |
| SCHEMBL5587168 | 0.73 | — | — | |
| SCHEMBL20267846 | 0.71 | — | — | |
| SCHEMBL28066800 | 0.71 | — | — | |
| SCHEMBL254190 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-6388117-B2 | REACTING AN AMINOORGANOSILANE, A UREA, AND AN ALCOHOL, OR REACTING AN AMINOORGANOSILANE AND A UREA IN AN ALCOHOL SOLVENT TO FORM A UREOORGAOSILANE, WHICH IS THEN REACTED WITH AN ALCOHOL | DEGUSSA AG (DE) | 2002-05-14 | — | — | US | disclosed |
| US-20020016486-A1 | PROCESS FOR PREPARING CARBAMATOORGANOSILANES AND ISOCYANATOORGANOSILANES | DEGUSSA AG (DE) | 2002-02-07 | — | — | US | disclosed |