⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3401573 | 0.71 | — | — | |
| SCHEMBL3401569 | 0.71 | — | — | |
| SCHEMBL354282 | 0.67 | — | — | |
| SCHEMBL1335799 | 0.67 | — | — | |
| Bicarbonate SCHEMBL27756623 | 0.65 | FFAR3 (0.42) | — | |
| SCHEMBL15302261 | 0.64 | — | — | |
| SCHEMBL15302567 | 0.64 | — | — | |
| SCHEMBL10706421 | 0.64 | — | — | |
| SCHEMBL15302619 | 0.64 | — | — | |
| Ammonia Solution, Strong SCHEMBL28288864 | 0.64 | ALDH1A1 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9512272-B2 | Curable composition containing silicone, and cured product thereof | CENTRAL GLASS COMPANY, LIMITED (JP) | 2016-12-06 | — | — | US | disclosed |
| US-20150322211-A1 | Curable Composition Containing Silicone, and Cured Product Thereof | CENTRAL GLASS COMPANY, LIMITED (JP) | 2015-11-12 | — | — | US | disclosed |