⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5939457 | 0.76 | CDK9 (0.33) | — | |
| SCHEMBL5939462 | 0.76 | CDK9 (0.33) | — | |
| Hydrochloric Acid SCHEMBL5938901 | 0.75 | CDK9 (0.33) | — | |
| Hydrochloric Acid SCHEMBL5938910 | 0.75 | CDK9 (0.33) | — | |
| SCHEMBL7607611 | 0.65 | CFTR (0.36) | — | |
| SCHEMBL24923905 | 0.65 | BRD4 (0.36) | — | |
| SCHEMBL7668468 | 0.64 | — | — | |
| SCHEMBL7185897 | 0.62 | SLC6A4 (0.48) | — | |
| SCHEMBL6843937 | 0.62 | SLC6A4 (0.48) | — | |
| SCHEMBL23716669 | 0.61 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-12030869-B2 | 5-membered heteroaryl carboxamide compounds for treatment of HBV | ASSEMBLY BIOSCIENCES, INC. (US) | 2024-07-09 | — | — | US | disclosed |
| US-12030869-B2 | 5-membered heteroaryl carboxamide compounds for treatment of HBV | ASSEMBLY BIOSCIENCES, INC. (US) | 2024-07-09 | — | — | US | disclosed |
| US-11560370-B1 | 5-membered heteroaryl carboxamide compounds for treatment of HBV | ASSEMBLY BIOSCIENCES, INC. (US) | 2023-01-24 | — | — | US | disclosed |
| CN-113195055-A | 5-membered heteroaryl carboxamide compounds for HBV therapy | 组装生物科学股份有限公司 | 2021-07-30 | — | — | CN | disclosed |