⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2805168 | 1.00 | — | — | |
| SCHEMBL109023 | 0.96 | — | — | |
| Fluoride SCHEMBL28303577 | 0.92 | — | — | |
| Ethane SCHEMBL29126000 | 0.92 | — | — | |
| Methane SCHEMBL1116289 | 0.92 | — | — | |
| Bromide SCHEMBL9709858 | 0.92 | — | — | |
| SCHEMBL10455387 | 0.92 | — | — | |
| SCHEMBL5961099 | 0.92 | — | — | |
| Water SCHEMBL28241835 | 0.92 | — | — | |
| Hydrochloric Acid SCHEMBL10570728 | 0.92 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109251318-A | A kind of oligomeric silsesquioxane modified solvent free organic siliconresin and preparation method thereof | 浙江启墨新材料科技有限公司 | 2019-01-22 | — | — | CN | claimed |
| CN-104789111-B | Oligoaniline compound | 日产化学工业株式会社 | 2018-05-01 | — | — | CN | disclosed |
| CN-104821375-B | Oligoaniline compound | 日产化学工业株式会社 | 2018-03-02 | — | — | CN | disclosed |
| CN-101679206-B | oligoaniline compound | NISSAN CHEMICAL INDUSTRIES, LTD. (JP) | 2016-05-11 | — | — | CN | disclosed |