⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17669079 | 0.94 | ALDH1A1 (0.30) | — | |
| SCHEMBL17668996 | 0.88 | — | — | |
| SCHEMBL17953129 | 0.83 | — | — | |
| SCHEMBL17668980 | 0.82 | — | — | |
| SCHEMBL17669022 | 0.82 | — | — | |
| SCHEMBL17669107 | 0.79 | — | — | |
| SCHEMBL319741 | 0.79 | MAPK1 (0.31) | — | |
| SCHEMBL17668941 | 0.77 | — | — | |
| SCHEMBL17669019 | 0.77 | — | — | |
| SCHEMBL10973993 | 0.75 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3009439-B1 | CYCLIC AMINOORGANOXYSILANE COMPOUND AND ITS PRODUCTION METHOD | SHINETSU CHEMICAL CO (JP) | 2018-01-03 | — | — | EP | disclosed |
| US-9371341-B2 | Cyclic aminoorganoxysilane compound and its production method | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2016-06-21 | — | — | US | disclosed |
| EP-3009439-A1 | CYCLIC AMINOORGANOXYSILANE COMPOUND AND ITS PRODUCTION METHOD | Shin-Etsu Chemical Co., Ltd. (JP) | 2016-04-20 | — | — | EP | disclosed |
| US-20160102111-A1 | CYCLIC AMINOORGANOXYSILANE COMPOUND AND ITS PRODUCTION METHOD | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2016-04-14 | — | — | US | disclosed |