⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL269003 | 0.92 | — | — | |
| Fluoride SCHEMBL31314693 | 0.88 | — | — | |
| Methane SCHEMBL6038342 | 0.88 | — | — | |
| Ammonia Solution, Strong SCHEMBL5393029 | 0.88 | — | — | |
| SCHEMBL27589487 | 0.88 | — | — | |
| Cyclopropane SCHEMBL5886605 | 0.81 | — | — | |
| Cyclopropane SCHEMBL21197462 | 0.79 | — | — | |
| Trimethylammonium SCHEMBL27280798 | 0.79 | — | — | |
| Acetic Acid SCHEMBL4342899 | 0.74 | FFAR3 (0.41) | — | |
| Ethylene SCHEMBL30185081 | 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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0309210-B1 | INHIBITION OF HYDRATE FORMATION | Conoco Phillips Company (US) | 1992-03-25 | — | — | EP | disclosed |
| US-4856593-A | Inhibition of hydrate formation | CONOCO INC. (US) | 1989-08-15 | — | — | US | disclosed |
| EP-0309210-A1 | Inhibition of hydrate formation | Conoco Phillips Company (US) | 1989-03-29 | — | — | EP | disclosed |