⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10705488 | 0.82 | — | — | |
| SCHEMBL11170476 | 0.79 | CHRM1 (0.35) | — | |
| SCHEMBL10706296 | 0.76 | ALDH1A1 (0.31) | — | |
| SCHEMBL10702837 | 0.74 | ALDH1A1 (0.34) | — | |
| SCHEMBL10704721 | 0.73 | — | — | |
| SCHEMBL11166765 | 0.72 | — | — | |
| SCHEMBL10705211 | 0.72 | — | — | |
| SCHEMBL9814628 | 0.69 | TDP1 (0.36) | — | |
| SCHEMBL9814670 | 0.69 | TDP1 (0.36) | — | |
| SCHEMBL11166888 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0094436-B1 | N-GLYCIDYL-SUBSTITUTED AMIDE COMPOUNDS | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1988-03-30 | — | — | EP | disclosed |
| EP-0094436-A1 | N-GLYCIDYL-SUBSTITUTED AMIDE COMPOUNDS | MITSUI TOATSU CHEMICALS, Inc. (JP) | 1983-11-23 | — | — | EP | disclosed |