⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23748269 | 0.85 | — | — | |
| SCHEMBL23748292 | 0.83 | HRH1 (0.30) | — | |
| SCHEMBL23748165 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL24834953 | 0.72 | L3MBTL1 (0.38) | — | |
| SCHEMBL23748201 | 0.70 | CTSA (0.31) | — | |
| SCHEMBL23748191 | 0.65 | EED (0.35) | — | |
| SCHEMBL23748146 | 0.63 | SQOR (0.30) | — | |
| SCHEMBL23748227 | 0.62 | SLC6A2 (0.33) | — | |
| SCHEMBL3958157 | 0.60 | PGK1 (0.36) | — | |
| SCHEMBL22431093 | 0.59 | TAAR1 (0.33) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11312727-B1 | Macrocyclic flu endonuclease inhibitors | Janssen Biopharma, Inc. (US) | 2022-04-26 | — | — | US | disclosed |
| EP-3864020-A1 | MACROCYCLIC FLU ENDONUCLEASE INHIBITORS | Janssen BioPharma, Inc. (US) | 2021-08-18 | — | — | EP | disclosed |
| CN-113195502-A | Macrocyclic influenza endonuclease inhibitors | 詹森生物制药有限公司 | 2021-07-30 | — | — | CN | disclosed |