⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8585800 | 0.85 | ELANE (0.32) | — | |
| SCHEMBL9842972 | 0.81 | — | — | |
| SCHEMBL5170532 | 0.76 | POLB (0.35) | — | |
| SCHEMBL3456679 | 0.75 | — | — | |
| SCHEMBL6542690 | 0.75 | — | — | |
| SCHEMBL16428784 | 0.75 | ALDH1A1 (0.33) | — | |
| SCHEMBL4752286 | 0.75 | POLB (0.31) | — | |
| SCHEMBL8745818 | 0.75 | — | — | |
| SCHEMBL16428828 | 0.75 | HTR2A (0.33) | — | |
| SCHEMBL3992251 | 0.75 | KDM1A (0.36) | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-105999391-B | A kind of preparation method of alginic acid hydrogel dressing | 武汉纺织大学 | 2019-03-29 | — | — | CN | claimed |
| CN-109081919-A | A method of addition reaction is clicked based on sulfydryl-alkene and prepares self-repair material | 安徽工业大学 | 2018-12-25 | — | — | CN | claimed |
| CN-105985484-B | A kind of preparation method of the high hydrophobic organic whole material of crosslinking | 中国科学院大连化学物理研究所 | 2018-03-02 | — | — | CN | disclosed |
| CN-107434833-A | A kind of Porous-Organic integral material and its preparation method and application | 中国科学院大连化学物理研究所 | 2017-12-05 | — | — | CN | disclosed |
| CN-107243000-A | Carry medicine hybridized nanometer particle and preparation method thereof | 四川大学 | 2017-10-13 | — | — | CN | disclosed |
| EP-1409125-A1 | MICROENCAPSULATED CATALYST, METHODS OF PREPARATION AND METHODS OF USE THEREOF | Avecia Limited (GB) | 2004-04-21 | — | — | EP | disclosed |
| WO-2003006151-A1 | MICROENCAPSULATED CATALYST, METHODS OF PREPARATION AND METHODS OF USE THEREOF | AVECIA LIMITED (GB) | 2003-01-23 | — | — | WO | disclosed |
| US-5508438-A | Phosphorus compounds | HOFFMANN-LA ROCHE INC. (US) | 1996-04-16 | — | — | US | disclosed |