⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21558321 | 0.88 | — | — | |
| SCHEMBL21788087 | 0.88 | — | — | |
| SCHEMBL24620027 | 0.86 | — | — | |
| SCHEMBL8214570 | 0.86 | — | — | |
| SCHEMBL24936128 | 0.85 | — | — | |
| SCHEMBL21907200 | 0.85 | ADORA3 (0.31) | — | |
| SCHEMBL26195860 | 0.85 | — | — | |
| SCHEMBL23848980 | 0.82 | KMT2A (0.36) | — | |
| SCHEMBL25785182 | 0.82 | — | — | |
| SCHEMBL20231259 | 0.81 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022130046-A1 | N-1 BRANCHED IMIDAZOQUINOLINES, CONJUGATES THEREOF, AND METHODS | 3M INNOVATIVE PROPERTIES COMPANY (US) | 2022-06-23 | — | — | WO | disclosed |