⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3627011 | 0.80 | ALDH1A1 (0.39) | — | |
| SCHEMBL3185888 | 0.77 | — | — | |
| SCHEMBL28117288 | 0.74 | — | — | |
| SCHEMBL5278906 | 0.72 | ALDH1A1 (0.31) | — | |
| SCHEMBL9745271 | 0.72 | ALDH1A1 (0.41) | — | |
| SCHEMBL9746200 | 0.71 | — | — | |
| SCHEMBL7519799 | 0.71 | — | — | |
| SCHEMBL7524768 | 0.71 | — | — | |
| SCHEMBL511965 | 0.71 | — | — | |
| Hydrochloric Acid SCHEMBL7609543 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5100762-A | Radiation-sensitive polymer and radiation-sensitive composition containing the same | MITSUBISHI DENKI KABUSHIKI KAISHA (JP) | 1992-03-31 | — | — | US | disclosed |