⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9753818 | 0.70 | — | — | |
| SCHEMBL10923505 | 0.68 | TDP1 (0.32) | — | |
| SCHEMBL8781206 | 0.67 | ALDH1A1 (0.37) | — | |
| SCHEMBL27494852 | 0.60 | MGAM (0.39) | — | |
| SCHEMBL3486881 | 0.60 | — | — | |
| SCHEMBL9545657 | 0.58 | ALDH1A1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL28132101 | 0.58 | — | — | |
| SCHEMBL11509108 | 0.57 | — | — | |
| SCHEMBL6775550 | 0.57 | — | — | |
| SCHEMBL42229 | 0.56 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0565574-A1 | ARTHROPODICIDAL CARBOXANILIDES. | DU PONT (US) | 1993-10-20 | — | — | EP | disclosed |