⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL389754 | 0.96 | — | — | |
| Trimethylammonium SCHEMBL15015537 | 0.87 | — | — | |
| SCHEMBL512422 | 0.78 | — | — | |
| SCHEMBL15542056 | 0.78 | — | — | |
| SCHEMBL441430 | 0.74 | — | — | |
| SCHEMBL303983 | 0.67 | — | — | |
| SCHEMBL27887210 | 0.65 | — | — | |
| SCHEMBL148091 | 0.64 | — | — | |
| SCHEMBL453572 | 0.63 | — | — | |
| SCHEMBL17480221 | 0.62 | — | — |
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-107057256-A | Copolymer and the hydrophilic material comprising the copolymer | 三井化学株式会社 | 2017-08-18 | — | — | CN | disclosed |
| CN-107043440-A | Copolymer and the hydrophilic material comprising the copolymer | 三井化学株式会社 | 2017-08-15 | — | — | CN | disclosed |
| CN-105102498-B | Copolymer and hydrophilic material comprising the same | 三井化学株式会社 | 2017-04-12 | — | — | CN | disclosed |
| CN-103842401-B | Compositions and the film formed by it | 三井化学株式会社 | 2016-12-21 | — | — | CN | disclosed |
| CN-105073917-B | The film formed by copolymer or compositions | 三井化学株式会社 | 2016-11-02 | — | — | CN | disclosed |
| CN-105102498-A | Copolymer and hydrophilic material comprising the same | MITSUI CHEMICALS INC | 2015-11-25 | — | — | CN | disclosed |
| CN-105073917-A | Film comprising copolymer or composition | MITSU CHEMICALS INC | 2015-11-18 | — | — | CN | disclosed |