⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL342702 | 1.00 | — | — | |
| SCHEMBL30735720 | 0.80 | — | — | |
| SCHEMBL762914 | 0.80 | — | — | |
| SCHEMBL305800 | 0.76 | — | — | |
| SCHEMBL30230776 | 0.76 | — | — | |
| SCHEMBL31619921 | 0.75 | — | — | |
| SCHEMBL971307 | 0.75 | — | — | |
| SCHEMBL913127 | 0.75 | — | — | |
| SCHEMBL31180717 | 0.75 | — | — | |
| SCHEMBL172774 | 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 |
|---|---|---|---|---|---|---|---|
| CN-114685491-B | Pyridin-2-amine derivatives, pharmaceutical compositions and uses thereof | 清华大学 | 2024-01-12 | — | — | CN | disclosed |
| WO-2022143985-A1 | PYRIDINE-2-AMINE DERIVATIVE AND PHARMACEUTICAL COMPOSITION AND USE THEREOF | 清华大学 | 2022-07-07 | — | — | WO | disclosed |
| CN-114685491-A | Pyridine-2-amine derivative and pharmaceutical composition and application thereof | 清华大学 | 2022-07-01 | — | — | CN | disclosed |