⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL28568112 | 0.94 | DNM1 (0.31) | — | |
| SCHEMBL4281435 | 0.75 | — | — | |
| SCHEMBL27808214 | 0.70 | ALDH1A1 (0.35) | — | |
| SCHEMBL28485511 | 0.69 | — | — | |
| SCHEMBL4266461 | 0.69 | — | — | |
| SCHEMBL7707764 | 0.69 | NFKB1 (0.33) | — | |
| SCHEMBL15289609 | 0.67 | — | — | |
| SCHEMBL37539 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL16632263 | 0.66 | ALDH1A1 (0.39) | — | |
| SCHEMBL28477445 | 0.64 | — | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20070232822-A1 | Azasilanes and method for making and using the same | GELEST, INC. (US) | 2007-10-04 | — | — | US | disclosed |
| US-20040077892-A1 | Azasilanes and methods for making and using the same | GELEST, INC. | 2004-04-22 | — | — | US | disclosed |
| WO-2003091186-A2 | AZASILANES AND METHODS FOR MAKING AND USING THE SAME | GELEST, INC. (US) | 2003-11-06 | — | — | WO | disclosed |