⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17621505 | 0.77 | — | — | |
| SCHEMBL17621501 | 0.77 | — | — | |
| SCHEMBL17761459 | 0.74 | — | — | |
| SCHEMBL17616472 | 0.72 | — | — | |
| SCHEMBL17616468 | 0.72 | — | — | |
| Water SCHEMBL6570674 | 0.72 | — | — | |
| SCHEMBL27872213 | 0.69 | — | — | |
| SCHEMBL17172 | 0.69 | — | — | |
| SCHEMBL17574479 | 0.69 | — | — | |
| SCHEMBL16243842 | 0.69 | — | — |
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-20230000878-A1 | PYRIDINE DERIVATIVES WITH N-LINKED CYCLIC SUBSTITUENTS AS cGAS INHIBITORS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2023-01-05 | — | — | US | disclosed |