⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21206 | 0.97 | — | — | |
| SCHEMBL11098706 | 0.94 | — | — | |
| Hydrochloric Acid SCHEMBL18740686 | 0.94 | — | — | |
| SCHEMBL28899342 | 0.94 | — | — | |
| SCHEMBL21268618 | 0.88 | ALDH1A1 (0.61) | — | |
| SCHEMBL7056633 | 0.86 | ALDH1A1 (0.36) | — | |
| SCHEMBL28949878 | 0.86 | ALDH1A1 (0.36) | — | |
| Acrylic Acid SCHEMBL6319653 | 0.86 | LMNA (0.53) | — | |
| Formamide SCHEMBL8433351 | 0.86 | — | — | |
| Acrylic Acid SCHEMBL7619573 | 0.84 | LMNA (0.50) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0786444-B1 | Process for producing acetaldehyde dimethylacetal | SHOWA DENKO KK (JP) | 1999-12-22 | — | — | EP | disclosed |
| EP-0570719-B1 | Process for producing acetaldehyde dimethylacetal | SHOWA DENKO KK (JP) | 1997-10-29 | — | — | EP | disclosed |
| EP-0786444-A1 | Process for producing acetaldehyde dimethylacetal | SHOWA DENKO KABUSHIKI KAISHA (JP) | 1997-07-30 | — | — | EP | disclosed |
| US-5362918-A | Process for producing acetaldehyde dimethylacetal | SHOWA DENKO K.K. (JP) | 1994-11-08 | — | — | US | disclosed |
| EP-0570719-A1 | Process for producing acetaldehyde dimethylacetal | SHOWA DENKO KABUSHIKI KAISHA (JP) | 1993-11-24 | — | — | EP | disclosed |