⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19674836 | 0.76 | — | — | |
| SCHEMBL9055528 | 0.76 | — | — | |
| SCHEMBL20408756 | 0.76 | — | — | |
| SCHEMBL2078545 | 0.76 | — | — | |
| SCHEMBL25639851 | 0.76 | — | — | |
| SCHEMBL26618928 | 0.73 | — | — | |
| SCHEMBL25975582 | 0.73 | — | — | |
| SCHEMBL22073639 | 0.71 | L3MBTL1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL26627662 | 0.71 | BLM (0.31) | — | |
| SCHEMBL16130006 | 0.70 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023154282-A1 | COMPOUNDS HAVING A T-STRUCTURE FORMED BY AT LEAST FOUR CYCLES FOR USE IN THE TREATMENT OF CANCER AND OTHER INDICATIONS | THERAS, INC. (US) | 2023-08-17 | — | — | WO | disclosed |