⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11473798 | 0.72 | MAPT (0.32) | — | |
| SCHEMBL27475271 | 0.71 | SCD (0.42) | — | |
| SCHEMBL27546349 | 0.70 | SCD (0.41) | — | |
| SCHEMBL908481 | 0.68 | LMNA (0.43) | — | |
| SCHEMBL908039 | 0.67 | ALDH1A1 (0.41) | — | |
| SCHEMBL31605659 | 0.65 | LGALS3 (0.35) | — | |
| Hydrochloric Acid SCHEMBL11558888 | 0.64 | MEN1 (0.33) | — | |
| SCHEMBL27881026 | 0.64 | L3MBTL1 (0.33) | — | |
| SCHEMBL1155990 | 0.63 | KDM4E (0.39) | — | |
| SCHEMBL31227412 | 0.62 | MAOA (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023005945-A1 | CYCLIC PEPTIDE, PREPARATION METHOD THEREFOR AND USE THEREOF | 杭州彗搏科技有限公司 | 2023-02-02 | — | — | WO | disclosed |
| CN-109336937-B | Preparation method of ribavirin | 河南省科学院高新技术研究中心 | 2020-08-25 | — | — | CN | disclosed |