⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL296998 | 0.94 | — | — | |
| Fluoride SCHEMBL27919984 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL11804288 | 0.89 | — | — | |
| SCHEMBL5013312 | 0.89 | — | — | |
| Benzene SCHEMBL27542723 | 0.77 | KDM4E (0.30) | — | |
| Propane SCHEMBL27846608 | 0.76 | — | — | |
| Iodide SCHEMBL28302997 | 0.70 | — | — | |
| Ethylamine SCHEMBL20487154 | 0.67 | — | — | |
| SCHEMBL4469756 | 0.67 | — | — | |
| SCHEMBL7906392 | 0.67 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1561841-A2 | Cleaning CVD Chambers following deposition of porogen-containing materials | AIR PRODUCTS AND CHEMICALS, INC. (US) | 2005-08-10 | — | — | EP | disclosed |
| US-20050161060-A1 | Cleaning CVD chambers following deposition of porogen-containing materials | AIR PRODUCTS AND CHEMICALS, INC. | 2005-07-28 | — | — | US | disclosed |