⚠ 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 | |
|---|---|---|---|---|
| Hexylene Glycol SCHEMBL6869929 | 1.00 | MAPK1 (0.39) | — | |
| Hexylene Glycol SCHEMBL123432 | 1.00 | — | — | |
| Hexylene Glycol SCHEMBL19379 | 1.00 | — | — | |
| Hexylene Glycol SCHEMBL8503452 | 0.97 | — | — | |
| Hexylene Glycol SCHEMBL6271981 | 0.97 | — | — | |
| Hexylene Glycol SCHEMBL1828185 | 0.97 | — | — | |
| Hexylene Glycol SCHEMBL1829463 | 0.97 | MAPK1 (0.38) | — | |
| Hexylene Glycol SCHEMBL11802241 | 0.97 | — | — | |
| Hexylene Glycol SCHEMBL28560190 | 0.97 | — | — | |
| Hexylene Glycol SCHEMBL9487674 | 0.97 | MAPK1 (0.38) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-114728886-B | Lipid compounds and compositions containing carbonates for intracellular delivery of therapeutic agents | 摩登纳特斯有限公司 | 2024-04-12 | — | — | CN | disclosed |
| CN-116507613-A | Bispecific antagonists of retinol binding protein 4 which stabilize transthyretin tetramer, their preparation and use in the treatment of common age-related complications | 纽约哥伦比亚大学理事会 | 2023-07-28 | — | — | CN | disclosed |
| EP-4031953-A1 | AUTOMATED SOLUTION DISPENSER | LabMinds Ltd (GB) | 2022-07-27 | — | — | EP | disclosed |
| CN-102728236-B | Coordination polymer membrane material, preparation method for same and application of same in membrane separation | UNIV JILIN | 2013-12-25 | — | — | CN | disclosed |
| CN-102728236-A | Coordination polymer membrane material, preparation method for same and application of same in membrane separation | UNIV JILIN | 2012-10-17 | — | — | CN | disclosed |
| US-8097422-B2 | Kir channel modulators | SALK INSTITUTE FOR BIOLOGICAL STUDIES (US) | 2012-01-17 | — | — | US | disclosed |
| US-20090148861-A1 | KIR CHANNEL MODULATORS | THE SALK INSTITUTE (US) | 2009-06-11 | — | — | US | disclosed |