⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21145988 | 0.74 | PIK3CD (0.31) | — | |
| SCHEMBL7772376 | 0.69 | CHRNB2 (0.37) | — | |
| SCHEMBL9261212 | 0.69 | MAPT (0.33) | — | |
| SCHEMBL24732011 | 0.69 | CHRNB2 (0.37) | — | |
| SCHEMBL85907 | 0.69 | — | — | |
| SCHEMBL14529581 | 0.67 | DRD2 (0.36) | — | |
| SCHEMBL13662108 | 0.67 | NSD2 (0.35) | — | |
| SCHEMBL14488739 | 0.66 | CHRNB2 (0.32) | — | |
| SCHEMBL14529943 | 0.66 | DRD2 (0.35) | — | |
| SCHEMBL15743954 | 0.66 | KDM4E (0.31) | — |
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-11560370-B1 | 5-membered heteroaryl carboxamide compounds for treatment of HBV | ASSEMBLY BIOSCIENCES, INC. (US) | 2023-01-24 | — | — | US | disclosed |