⚠ 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 | |
|---|---|---|---|---|
| Methoxymethane SCHEMBL28764878 | 0.84 | — | — | |
| SCHEMBL16144920 | 0.82 | — | — | |
| SCHEMBL19049 | 0.82 | — | — | |
| SCHEMBL30366305 | 0.76 | — | — | |
| Bromide SCHEMBL10323027 | 0.76 | — | — | |
| Ammonia Solution, Strong SCHEMBL297825 | 0.76 | — | — | |
| SCHEMBL29035022 | 0.76 | — | — | |
| Isobutane SCHEMBL7741602 | 0.76 | — | — | |
| Water SCHEMBL10718204 | 0.76 | — | — | |
| Methoxymethane SCHEMBL10890568 | 0.74 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-6193954-B1 | ADMINISTERING THERAPEUTICALLY EFFECTIVE AMOUNT OF DRUG DOPAMINE AGONIST, A PROPELLANT AND POLOXAME TO PATIENT | ABBOTT LABORATORIES | 2001-02-27 | — | — | US | claimed |