⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL724589 | 0.62 | — | — | |
| SCHEMBL3804321 | 0.61 | — | — | |
| SCHEMBL11053499 | 0.56 | — | — | |
| SCHEMBL11781263 | 0.56 | — | — | |
| SCHEMBL1047030 | 0.56 | — | — | |
| SCHEMBL18492630 | 0.56 | — | — | |
| SCHEMBL538778 | 0.56 | — | — | |
| SCHEMBL15577105 | 0.54 | KDM1A (0.33) | — | |
| SCHEMBL15577103 | 0.54 | KDM1A (0.33) | — | |
| SCHEMBL1790423 | 0.51 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1031593-B1 | Aqueous aminofunctional silicon compounds containing composition | DEGUSSA (DE) | 2003-10-29 | — | — | EP | disclosed |
| US-6534667-B1 | Low viscosity, largely storage stable composition which comprises mixture of water soluble, amino-functional silicon compounds which are essentially free from alkoxy groups, and water | DEGUSSA- AG (DE) | 2003-03-18 | — | — | US | disclosed |
| EP-1031593-A2 | Aqueous aminofunctional silicon compounds containing composition | Degussa-Hüls Aktiengesellschaft (DE) | 2000-08-30 | — | — | EP | disclosed |