⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1694571 | 0.75 | CDK2 (0.33) | — | |
| SCHEMBL14417041 | 0.72 | — | — | |
| SCHEMBL22314882 | 0.72 | — | — | |
| SCHEMBL24029384 | 0.70 | FAAH (0.42) | — | |
| SCHEMBL786579 | 0.64 | — | — | |
| SCHEMBL20375528 | 0.62 | — | — | |
| SCHEMBL15481034 | 0.62 | — | — | |
| SCHEMBL890258 | 0.62 | — | — | |
| SCHEMBL24176434 | 0.61 | — | — | |
| SCHEMBL12146395 | 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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-11352371-B2 | Thienopyrimidine derivatives as ACC inhibitors and uses thereof | GILEAD SCIENCES, INC. (US) | 2022-06-07 | — | — | US | disclosed |
| US-20210053990-A1 | THIENOPYRIMIDINE DERIVATIVES AS ACC INHIBITORS AND USES THEREOF | GILEAD SCIENCES, INC. | 2021-02-25 | — | — | US | disclosed |