⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10986425 | 0.82 | TBXAS1 (0.39) | — | |
| SCHEMBL411293 | 0.78 | — | — | |
| SCHEMBL27783142 | 0.78 | — | — | |
| SCHEMBL16728318 | 0.78 | — | — | |
| SCHEMBL20445473 | 0.78 | — | — | |
| SCHEMBL19441143 | 0.78 | — | — | |
| SCHEMBL27397933 | 0.78 | ALDH1A1 (0.37) | — | |
| SCHEMBL28484389 | 0.77 | TBXAS1 (0.37) | — | |
| SCHEMBL12016623 | 0.77 | ALDH1A1 (0.39) | — | |
| SCHEMBL13086506 | 0.75 | TBXAS1 (0.39) | — |
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-2021180774-A1 | MODULATORS OF THE INTEGRATED STRESS RESPONSE PATHWAY | EVOTEC INTERNATIONAL GMBH (DE) | 2021-09-16 | — | — | WO | disclosed |