⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL315580 | 0.97 | — | — | |
| SCHEMBL2064703 | 0.97 | — | — | |
| Ammonia Solution, Strong SCHEMBL8973655 | 0.94 | — | — | |
| SCHEMBL11787617 | 0.86 | ALDH1A1 (0.46) | — | |
| SCHEMBL28482554 | 0.79 | — | — | |
| SCHEMBL28356809 | 0.79 | — | — | |
| SCHEMBL589190 | 0.79 | — | — | |
| SCHEMBL11709196 | 0.78 | — | — | |
| SCHEMBL2898806 | 0.77 | — | — | |
| SCHEMBL7125789 | 0.76 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-106432377-A | Glucoside, preparation method and applications thereof | 中石化石油工程技术服务有限公司 | 2017-02-22 | — | — | CN | disclosed |
| CN-106432375-A | Polyether amine alkyl glycoside and preparation method and application thereof | 中石化石油工程技术服务有限公司 | 2017-02-22 | — | — | CN | disclosed |