⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8767159 | 0.73 | TRPA1 (0.33) | — | |
| SCHEMBL136797 | 0.70 | — | — | |
| SCHEMBL14881257 | 0.70 | KDM4E (0.46) | — | |
| SCHEMBL22393526 | 0.69 | CA1 (0.33) | — | |
| SCHEMBL29349433 | 0.67 | — | — | |
| SCHEMBL15773516 | 0.67 | — | — | |
| SCHEMBL31684043 | 0.67 | — | — | |
| SCHEMBL19513318 | 0.67 | — | — | |
| Dimethyl Sulfone SCHEMBL169867 | 0.65 | KDM4E (1.00) | — | |
| Dimethyl Sulfone SCHEMBL19382 | 0.65 | — | — |
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-117050023-A | Method for preparing 5-fluorocytosine | 浙江省化工研究院有限公司 | 2023-11-14 | — | — | CN | claimed |
| CN-114730876-B | Electrode and electrochemical device | 大金工业株式会社 | 2024-09-27 | — | — | CN | disclosed |
| CN-117913278-A | Electrode, secondary battery including the same, and method of manufacturing the same | 株式会社LG新能源 | 2024-04-19 | — | — | CN | disclosed |
| CN-111954949-B | Electrode, secondary battery including the same, and method of manufacturing the same | 株式会社LG新能源 | 2024-02-02 | — | — | CN | disclosed |
| CN-116057036-A | Fluorine-containing carboxylate compound | 大金工业株式会社 | 2023-05-02 | — | — | CN | disclosed |
| EP-0906338-A1 | GLUCAGON-LIKE PEPTIDE-2 ANALOGS | 1149336 ONTARIO INC. (CA) | 1999-04-07 | — | — | EP | disclosed |
| WO-1997039031-A1 | GLUCAGON-LIKE PEPTIDE-2 ANALOGS | 1149336 ONTARIO INC. (CA) | 1997-10-23 | — | — | WO | disclosed |