⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL221883 | 0.97 | — | — | |
| Bromide SCHEMBL28959975 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL6298787 | 0.94 | — | — | |
| SCHEMBL30672672 | 0.85 | — | — | |
| SCHEMBL30434166 | 0.81 | — | — | |
| SCHEMBL28379045 | 0.81 | — | — | |
| SCHEMBL31658718 | 0.78 | — | — | |
| Pyrene SCHEMBL27902770 | 0.76 | ALDH1A1 (0.42) | — | |
| SCHEMBL31658721 | 0.71 | — | — | |
| SCHEMBL28065111 | 0.69 | — | — |
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-106133080-B | Adhesive composition, adhesive composition for polarizing plate, adhesive for polarizing plate, and polarizing plate using same | 三菱化学株式会社 | 2019-06-11 | — | — | CN | disclosed |
| CN-109071446-A | The organic reaction carried out in aqueous solution in the presence of hydroxy alkyl (alkyl) cellulose or alkylcellulose | 艾伯维德国有限责任两合公司 | 2018-12-21 | — | — | CN | disclosed |