⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2582328 | 0.75 | CA1 (0.47) | — | |
| SCHEMBL21681 | 0.75 | — | — | |
| SCHEMBL4178096 | 0.72 | — | — | |
| SCHEMBL16760664 | 0.72 | — | — | |
| SCHEMBL28395217 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL5733160 | 0.72 | — | — | |
| SCHEMBL7737443 | 0.72 | CA1 (0.35) | — | |
| Lithium SCHEMBL31511739 | 0.72 | — | — | |
| SCHEMBL10788224 | 0.72 | — | — | |
| Methane SCHEMBL27881065 | 0.72 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9951164-B2 | Non-ionic aryl ketone based polymeric photo-acid generators | INTERNATIONAL BUSINESS MACHINES CORPORATION (US) | 2018-04-24 | — | — | US | disclosed |
| US-20180044459-A1 | NON-IONIC ARYL KETONE BASED POLYMERIC PHOTO-ACID GENERATORS | CENTRAL GLASS CO., LTD. (JP) | 2018-02-15 | — | — | US | disclosed |