⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL67846 | 0.76 | — | — | |
| SCHEMBL28090128 | 0.76 | — | — | |
| Hydrogen Sulfide SCHEMBL27649694 | 0.72 | — | — | |
| SCHEMBL11072942 | 0.72 | — | — | |
| Ammonia Solution, Strong SCHEMBL28253347 | 0.72 | — | — | |
| SCHEMBL28720554 | 0.72 | — | — | |
| SCHEMBL27587062 | 0.72 | — | — | |
| Methane SCHEMBL27336272 | 0.72 | — | — | |
| Cyclopentane SCHEMBL7740535 | 0.67 | — | — | |
| Methylamine SCHEMBL27303827 | 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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-113979931-B | Pyridine 3-amine derivative and preparation method and application thereof | 南方医科大学 | 2023-06-13 | — | — | CN | claimed |
| CN-113979931-B | Pyridine 3-amine derivative and preparation method and application thereof | 南方医科大学 | 2023-06-13 | — | — | CN | disclosed |
| CN-113979931-B | Pyridine 3-amine derivative and preparation method and application thereof | 南方医科大学 | 2023-06-13 | — | — | CN | disclosed |
| US-6265620-B1 | REACTING OLEFINIC COMPOUND WITH CARBON MONOXIDE AND HYDROGEN IN PRESENCE OF CATALYST CONTAINING METAL OF GROUP 8 TO 10 AND TRIVALENT ORANIC PHOSPHORUS COMPOUND TO PRODUCE ALDEHYDE | MITSUBISHI CHEMICAL CORPORATION (JP) | 2001-07-24 | — | — | US | disclosed |