⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18289219 | 0.73 | — | — | |
| SCHEMBL25031259 | 0.69 | — | — | |
| SCHEMBL24754464 | 0.69 | — | — | |
| SCHEMBL25132425 | 0.69 | — | — | |
| SCHEMBL22431138 | 0.69 | ALDH1A1 (0.30) | — | |
| SCHEMBL21210690 | 0.67 | — | — | |
| SCHEMBL8063871 | 0.65 | — | — | |
| SCHEMBL575531 | 0.65 | CA2 (0.44) | — | |
| Isopropyl Alcohol SCHEMBL9431191 | 0.65 | — | — | |
| SCHEMBL2016777 | 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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20230134821-A1 | MYC-MAX INHIBITOR COMPOUND THERAPEUTICS FOR CANCER TREATMENT, METHODS AND USES ASSOCIATED THEREWITH | THE UNIVERSITY OF BRITISH COLUMBIA (CA) | 2023-05-04 | — | — | US | disclosed |