⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3720367 | 0.81 | — | — | |
| SCHEMBL2342530 | 0.72 | ALDH1A1 (0.31) | — | |
| Phosphine SCHEMBL3910970 | 0.71 | — | — | |
| SCHEMBL35885 | 0.71 | — | — | |
| SCHEMBL28028831 | 0.71 | — | — | |
| SCHEMBL10974292 | 0.70 | — | — | |
| SCHEMBL28916497 | 0.70 | — | — | |
| SCHEMBL11365229 | 0.70 | — | — | |
| Propylene Oxide SCHEMBL28674335 | 0.69 | SMN1; SMN2 (0.32) | — | |
| SCHEMBL7999566 | 0.69 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114787238-B | Silane-terminated polyether emulsions for coating applications | 瓦克化学股份公司 | 2024-05-24 | — | — | CN | disclosed |
| CN-116897185-A | Mixtures comprising phosphorus-containing compounds and use thereof | 瓦克化学股份公司 | 2023-10-17 | — | — | CN | disclosed |
| CN-113574031-B | Method for reducing or avoiding alkali-aggregate reactions in set concrete | 瓦克化学股份公司 | 2023-09-05 | — | — | CN | disclosed |
| CN-116348089-A | Method for producing alkyl silicone resin | 瓦克化学股份公司 | 2023-06-27 | — | — | CN | disclosed |
| CN-116134094-A | Crosslinkable compositions based on organosilicon compounds | 瓦克化学股份公司 | 2023-05-16 | — | — | CN | disclosed |
| CN-113574031-A | Method for reducing or avoiding alkali-aggregate reactions in set concrete | 瓦克化学股份公司 | 2021-10-29 | — | — | CN | disclosed |