⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL27796311 | 0.97 | ALDH1A1 (0.52) | — | |
| SCHEMBL11060536 | 0.97 | ALDH1A1 (0.56) | — | |
| SCHEMBL24200 | 0.97 | — | — | |
| SCHEMBL28307391 | 0.97 | ALDH1A1 (0.56) | — | |
| SCHEMBL4002515 | 0.97 | ALDH1A1 (0.56) | — | |
| SCHEMBL4406443 | 0.94 | — | — | |
| SCHEMBL29159554 | 0.94 | — | — | |
| Acetone SCHEMBL9495889 | 0.94 | ALDH1A1 (0.54) | — | |
| SCHEMBL5862125 | 0.94 | — | — | |
| SCHEMBL9860399 | 0.94 | — | — |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-109208066-B | Single crystal preparation method of ferroelectric ceramic compound | 苏州科技大学 | 2021-03-12 | — | — | CN | disclosed |
| CN-109402737-B | Method for preparing lead zirconate titanate single crystal at low temperature | 苏州科技大学 | 2021-02-19 | — | — | CN | disclosed |
| CN-109402737-A | The method of low temperature preparation lead zirconate titanate monocrystalline | 苏州科技大学 | 2019-03-01 | — | — | CN | disclosed |
| CN-109208066-A | The method for preparing single crystal of ferroelectric ceramics class compound | 苏州科技大学 | 2019-01-15 | — | — | CN | disclosed |
| US-6984745-B2 | Environmentally benign lead zirconate titanate ceramic precursor materials | RAYTHEON COMPANY (US) | 2006-01-10 | — | — | US | disclosed |
| US-20050168916-A1 | Environmentally benign lead zirconate titanate ceramic precursor materials | RAYTHEON COMPANY | 2005-08-04 | — | — | US | disclosed |