⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL42944 | 0.97 | — | — | |
| SCHEMBL9777270 | 0.93 | MEN1 (0.48) | — | |
| SCHEMBL20421972 | 0.93 | MEN1 (0.48) | — | |
| SCHEMBL8622831 | 0.93 | MEN1 (0.48) | — | |
| SCHEMBL277997 | 0.93 | MEN1 (0.48) | — | |
| Alcohol SCHEMBL17821479 | 0.91 | TSHR (0.50) | — | |
| SCHEMBL11703529 | 0.91 | MEN1 (0.47) | — | |
| SCHEMBL89068 | 0.90 | — | — | |
| SCHEMBL18291027 | 0.89 | MEN1 (0.45) | — | |
| Ethylene Glycol SCHEMBL277996 | 0.89 | TSHR (0.54) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-101918508-A | Composition containing perfluorobutyl ether | ARKEMA FRANCE | 2010-12-15 | — | — | CN | claimed |
| CN-105666752-A | Fluorosilicone release agent composite | 衢州氟硅技术研究院 | 2016-06-15 | — | — | CN | disclosed |
| CN-102639478-B | Process for manufacturing acrolein and/or acrylic acid from glycerol | ARKEMA FRANCE | 2015-04-01 | — | — | CN | disclosed |
| CN-102639479-B | Method for manufacturing acrolein and/or acrylic acid from glycerol | ARKEMA FRANCE | 2014-11-26 | — | — | CN | disclosed |
| CN-102639479-A | Method for manufacturing acrolein and/or acrylic acid from glycerol | ARKEMA FRANCE | 2012-08-15 | — | — | CN | disclosed |
| CN-102639478-A | Process for manufacturing acrolein and/or acrylic acid from glycerol | ARKEMA FRANCE | 2012-08-15 | — | — | CN | disclosed |
| CN-101918508-A | Composition containing perfluorobutyl ether | ARKEMA FRANCE | 2010-12-15 | — | — | CN | disclosed |