⚠ 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 | |
|---|---|---|---|---|
| Hydrogen Peroxide SCHEMBL27851222 | 0.87 | — | — | |
| Hydrogen Peroxide SCHEMBL992945 | 0.87 | — | — | |
| Hydrogen Peroxide SCHEMBL102345 | 0.87 | — | — | |
| Hydrogen Peroxide SCHEMBL11126695 | 0.87 | — | — | |
| Hydrogen Peroxide SCHEMBL102346 | 0.87 | — | — | |
| Hydrogen Peroxide SCHEMBL2881743 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL11175861 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL3039401 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL9296824 | 0.75 | — | — | |
| Hydrogen Peroxide SCHEMBL6049906 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20250345779-A1 | CATALYSTS AND PROCESSES FOR A REVERSE WATER GAS SHIFT REACTION FOR CONVERTING CARBON DIOXIDE TO CARBON MONOXIDE | SAUDI ARABIAN OIL COMPANY (SA) | 2025-11-13 | — | — | US | disclosed |
| US-7217827-B2 | Halogen-containing aromatic compound | NIPPON SHOKUBAI CO., LTD. (JP) | 2007-05-15 | — | — | US | disclosed |
| US-20050090691-A1 | Halogen-containing aromatic compound | NIPPON SHOKUBAI CO., LTD., A JAPAN CORPORATION | 2005-04-28 | — | — | US | disclosed |