⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL129239 | 0.89 | — | — | |
| SCHEMBL10771281 | 0.87 | — | — | |
| SCHEMBL3483401 | 0.87 | — | — | |
| Ammonia Solution, Strong SCHEMBL7099069 | 0.87 | — | — | |
| Ammonia Solution, Strong SCHEMBL278128 | 0.87 | — | — | |
| SCHEMBL2160293 | 0.87 | — | — | |
| Acrylic Acid SCHEMBL27709464 | 0.81 | LMNA (0.34) | — | |
| Alcohol SCHEMBL28839408 | 0.80 | — | — | |
| Acrylamide SCHEMBL29277077 | 0.79 | ALDH1A1 (0.37) | — | |
| SCHEMBL15021984 | 0.73 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-109721734-B | Double-end alkoxy silicone resin and preparation method thereof | 上海东大化学有限公司 | 2021-08-03 | — | — | CN | claimed |
| CN-109721734-B | Double-end alkoxy silicone resin and preparation method thereof | 上海东大化学有限公司 | 2021-08-03 | — | — | CN | disclosed |
| CN-109721734-B | Double-end alkoxy silicone resin and preparation method thereof | 上海东大化学有限公司 | 2021-08-03 | — | — | CN | disclosed |