⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL344367 | 1.00 | — | — | |
| Cetohexazine SCHEMBL1700926 | 0.78 | — | — | |
| SCHEMBL7709627 | 0.74 | — | — | |
| SCHEMBL14123454 | 0.74 | — | — | |
| SCHEMBL31309382 | 0.74 | — | — | |
| SCHEMBL25356137 | 0.69 | UPP1 (0.32) | — | |
| SCHEMBL20606838 | 0.69 | LMNA (0.33) | — | |
| SCHEMBL30442413 | 0.69 | KDM4E (0.44) | — | |
| SCHEMBL9156518 | 0.67 | KDM4E (0.42) | — | |
| SCHEMBL30489853 | 0.67 | CA1 (0.41) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2024081967-A2 | BIOBASED AND BIODEGRADABLE CORROSION INHIBITION COMPOSITION | ZestBio, Inc. (US) | 2024-04-18 | — | — | WO | disclosed |
| CN-113166029-B | Process for preparing carbonate derivatives | 国立大学法人神户大学 | 2023-11-21 | — | — | CN | disclosed |
| CN-110637006-B | Process for producing carbonate derivative | 国立大学法人神户大学 | 2022-05-24 | — | — | CN | disclosed |