⚠ 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 | |
|---|---|---|---|---|
| Ammonia Solution, Strong SCHEMBL3279179 | 1.00 | — | — | |
| Ammonia Solution, Strong SCHEMBL1506954 | 0.88 | — | — | |
| Ammonia Solution, Strong SCHEMBL193771 | 0.88 | MEN1 (0.67) | — | |
| Ammonia Solution, Strong SCHEMBL4814853 | 0.88 | — | — | |
| Ammonia Solution, Strong SCHEMBL4347931 | 0.88 | MEN1 (0.67) | — | |
| Ammonia Solution, Strong SCHEMBL3745234 | 0.88 | MEN1 (0.67) | — | |
| Ammonia Solution, Strong SCHEMBL4896558 | 0.88 | — | — | |
| Ammonia Solution, Strong SCHEMBL3624789 | 0.88 | MEN1 (0.67) | — | |
| Ammonia Solution, Strong SCHEMBL6473773 | 0.88 | — | — | |
| Ammonia Solution, Strong SCHEMBL2535368 | 0.88 | — | — |
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-20020148758-A1 | Gasoline hydrodesulfurization | RENESAS TECHNOLOGY CORP. (JP) | 2002-10-17 | — | — | US | disclosed |
| WO-2002062928-A2 | GASOLINE HYDRODESULFURIZATION | ABB LUMMUS GLOBAL, INC. (US) | 2002-08-15 | — | — | WO | disclosed |