⚠ 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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL11366810 | 0.98 | USP2 (0.39) | — | |
| SCHEMBL28006566 | 0.82 | USP2 (0.42) | — | |
| Glycerin SCHEMBL28851550 | 0.81 | LMNA (0.43) | — | |
| SCHEMBL4871906 | 0.77 | — | — | |
| SCHEMBL27559402 | 0.76 | LMNA (0.36) | — | |
| SCHEMBL3419419 | 0.76 | LMNA (0.46) | — | |
| SCHEMBL28451487 | 0.76 | USP2 (0.55) | — | |
| SCHEMBL2058179 | 0.75 | — | — | |
| SCHEMBL1487958 | 0.75 | — | — | |
| SCHEMBL19080618 | 0.75 | — | — |
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-110182808-B | Preparation method of silicon-carbon alkene and method for preparing hydrogen by photolysis of water vapor | 武汉楚能电子有限公司 | 2022-06-10 | — | — | CN | disclosed |
| CN-109689723-B | Polyol composition | 陶氏环球技术有限责任公司 | 2022-04-29 | — | — | CN | disclosed |
| CN-109689723-A | Glycol composition | 陶氏环球技术有限责任公司 | 2019-04-26 | — | — | CN | disclosed |