⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL29014075 | 0.74 | LMNA (0.38) | — | |
| SCHEMBL29829426 | 0.72 | ABHD6 (0.36) | — | |
| SCHEMBL28798851 | 0.72 | ABHD6 (0.36) | — | |
| SCHEMBL14321151 | 0.71 | PDK1 (0.39) | — | |
| SCHEMBL18989119 | 0.69 | — | — | |
| SCHEMBL18989120 | 0.69 | — | — | |
| SCHEMBL19557849 | 0.67 | GPR3 (0.31) | — | |
| SCHEMBL16794392 | 0.67 | MAPT (0.40) | — | |
| SCHEMBL16794391 | 0.67 | MAPT (0.40) | — | |
| SCHEMBL1824203 | 0.65 | MEN1 (0.45) | — |
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 |
|---|---|---|---|---|---|---|---|
| CN-114853814-A | Plasmin inhibitor, preparation method and application thereof | 赛诺哈勃药业（成都）有限公司 | 2022-08-05 | — | — | CN | disclosed |