⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9852788 | 1.00 | — | — | |
| Acetic Acid SCHEMBL9240467 | 0.95 | FFAR3 (0.37) | — | |
| Acetic Acid SCHEMBL10866192 | 0.88 | FFAR3 (0.32) | — | |
| SCHEMBL9504203 | 0.80 | — | — | |
| SCHEMBL9504218 | 0.80 | — | — | |
| SCHEMBL8651771 | 0.75 | TSHR (0.33) | — | |
| SCHEMBL8651775 | 0.75 | TSHR (0.33) | — | |
| SCHEMBL10516298 | 0.74 | — | — | |
| SCHEMBL3931614 | 0.73 | TSHR (0.32) | — | |
| SCHEMBL5186150 | 0.72 | AKR1B1 (0.41) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112341440-B | Immunomodulator | 成都先导药物开发股份有限公司 | 2022-05-31 | — | — | CN | disclosed |
| CN-114206328-A | Alcohol derivatives as Kv7 potassium channel openers for use in epilepsy or seizures | H.隆德贝克有限公司 | 2022-03-18 | — | — | CN | disclosed |
| CN-104837863-B | Proteolytic inactivation of selected proteins in bacterial extracts for enhanced expression | 苏特罗生物制药公司 | 2018-06-19 | — | — | CN | disclosed |
| CN-104837863-A | Proteolytic inactivation of selected proteins in bacterial extracts for enhanced expression | SUTRO BIOPHARMA INC | 2015-08-12 | — | — | CN | disclosed |
| EP-0413312-A1 | Additive for fluxes and soldering pastes | YUHO CHEMICALS INC. (JP) | 1991-02-20 | — | — | EP | disclosed |