⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4252534 | 1.00 | — | — | |
| SCHEMBL28901 | 1.00 | — | — | |
| Fluoride SCHEMBL28799672 | 0.97 | TP53 (0.39) | — | |
| Potassium SCHEMBL30618216 | 0.97 | — | — | |
| Ammonia Solution, Strong SCHEMBL27887638 | 0.97 | — | — | |
| Lithium SCHEMBL30618215 | 0.97 | — | — | |
| SCHEMBL127766 | 0.97 | — | — | |
| SCHEMBL16563700 | 0.97 | — | — | |
| Ethane SCHEMBL18092903 | 0.97 | TP53 (0.39) | — | |
| Hydrochloric Acid SCHEMBL27779767 | 0.97 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1640654-B1 | Ionic liquid based mixtures for gas storage and delivery | AIR PROD & CHEM (US) | 2016-10-19 | — | — | EP | disclosed |
| US-8202446-B2 | Ionic liquid based mixtures for gas storage and delivery | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2012-06-19 | — | — | US | disclosed |
| US-20090272938-A1 | Ionic Liquid Based Mixtures For Gas Storage and Delivery | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2009-11-05 | — | — | US | disclosed |
| US-7563308-B2 | Ionic liquid based mixtures for gas storage and delivery | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2009-07-21 | — | — | US | disclosed |
| US-7404845-B2 | Ionic liquid based mixtures for gas storage and delivery | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2008-07-29 | — | — | US | disclosed |
| EP-1640654-A1 | Ionic liquid based mixtures for gas storage and delivery | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2006-03-29 | — | — | EP | disclosed |
| US-20060060817-A1 | Ionic liquid based mixtures for gas storage and delivery | VERSUM MATERIALS US, LLC | 2006-03-23 | — | — | US | disclosed |
| US-20060060818-A1 | Ionic liquid based mixtures for gas storage and delivery | VERSUM MATERIALS US, LLC | 2006-03-23 | — | — | US | disclosed |