⚠ 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 | |
|---|---|---|---|---|
| Ethylenediamine SCHEMBL27991902 | 0.83 | ALDH1A1 (0.30) | — | |
| SCHEMBL28095268 | 0.82 | — | — | |
| SCHEMBL2156398 | 0.82 | ALDH1A1 (0.32) | — | |
| Ethylamine SCHEMBL28056822 | 0.81 | ALDH1A1 (0.31) | — | |
| SCHEMBL27674343 | 0.81 | — | — | |
| SCHEMBL28106994 | 0.80 | ALDH1A1 (0.30) | — | |
| Water SCHEMBL28060834 | 0.80 | ALDH1A1 (0.30) | — | |
| Ammonia Solution, Strong SCHEMBL27991089 | 0.80 | ALDH1A1 (0.30) | — | |
| Phosphine SCHEMBL28031041 | 0.80 | ALDH1A1 (0.30) | — | |
| SCHEMBL1703108 | 0.79 | DNM1 (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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105435645-B | A kind of composite nanometer filtering film and preparation method thereof | 中国石油化工股份有限公司 | 2017-09-29 | — | — | CN | claimed |
| CN-106835717-B | A kind of cotton fabric increasing is deep to increase gorgeous organic silicone finishing agent and preparation method thereof | 清远市宏图助剂有限公司 | 2019-02-19 | — | — | CN | disclosed |
| CN-104245867-B | epoxy siloxane coating composition | PPG工业俄亥俄公司 | 2017-06-27 | — | — | CN | disclosed |
| CN-106835717-A | A kind of bafta increases deep gorgeous organic silicone finishing agent of increasing and preparation method thereof | 清远市宏图助剂有限公司 | 2017-06-13 | — | — | CN | disclosed |
| CN-102898883-B | Coating composition, use the method for its coated material surface and there is the material that its surface processes | 道康宁(中国)投资有限公司 | 2016-08-24 | — | — | CN | disclosed |