⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16714739 | 0.89 | — | — | |
| SCHEMBL16714777 | 0.82 | — | — | |
| SCHEMBL16714819 | 0.80 | — | — | |
| SCHEMBL28769736 | 0.80 | — | — | |
| SCHEMBL16714832 | 0.71 | GRIN1 (0.30) | — | |
| SCHEMBL16714825 | 0.70 | — | — | |
| SCHEMBL703921 | 0.68 | ALDH1A1 (0.37) | — | |
| SCHEMBL172366 | 0.68 | MMP1 (0.33) | — | |
| SCHEMBL3312355 | 0.68 | MMP1 (0.33) | — | |
| SCHEMBL13178779 | 0.68 | MMP1 (0.33) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-9862812-B2 | Composition containing nitrogen-containing organoxysilane compound and method for making the same | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2018-01-09 | — | — | US | disclosed |
| EP-2876111-B1 | Composition containing nitrogen-containing organoxysilane compound and method for making the same | SHINETSU CHEMICAL CO (JP) | 2017-09-20 | — | — | EP | disclosed |
| EP-2876111-A1 | Composition containing nitrogen-containing organoxysilane compound and method for making the same | Shin-Etsu Chemical Co., Ltd. (JP) | 2015-05-27 | — | — | EP | disclosed |
| US-20150135996-A1 | COMPOSITION CONTAINING NITROGEN-CONTAINING ORGANOXYSILANE COMPOUND AND METHOD FOR MAKING THE SAME | SHIN-ETSU CHEMICAL CO., LTD. (JP) | 2015-05-21 | — | — | US | disclosed |