⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21244739 | 0.71 | ALDH1A1 (0.34) | — | |
| SCHEMBL9636678 | 0.71 | ALDH1A1 (0.34) | — | |
| SCHEMBL7804617 | 0.63 | ALDH1A1 (0.37) | — | |
| SCHEMBL4284111 | 0.62 | ALDH1A1 (0.31) | — | |
| SCHEMBL30643428 | 0.62 | ALDH1A1 (0.37) | — | |
| SCHEMBL13661456 | 0.61 | ALDH1A1 (0.33) | — | |
| SCHEMBL2349502 | 0.60 | ALDH1A1 (0.41) | — | |
| SCHEMBL11854679 | 0.60 | MEN1 (0.48) | — | |
| SCHEMBL9413690 | 0.60 | MEN1 (0.40) | — | |
| SCHEMBL21988516 | 0.59 | CYP19A1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-4565228-A2 | COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS | Kojin Therapeutics, Inc. (US) | 2025-06-11 | — | — | EP | disclosed |
| WO-2024030960-A2 | COMPOSITIONS AND METHODS FOR INDUCING FERROPTOSIS | Kojin Therapeutics, Inc. (US) | 2024-02-08 | — | — | WO | disclosed |