⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25561753 | 0.85 | DPP4 (0.33) | — | |
| SCHEMBL21145551 | 0.84 | — | — | |
| SCHEMBL26170436 | 0.84 | — | — | |
| SCHEMBL14038216 | 0.84 | — | — | |
| SCHEMBL26170333 | 0.84 | — | — | |
| SCHEMBL20289190 | 0.82 | HRH3 (0.31) | — | |
| SCHEMBL4099991 | 0.81 | — | — | |
| SCHEMBL22302281 | 0.80 | — | — | |
| SCHEMBL21146199 | 0.78 | GBA1 (0.33) | — | |
| SCHEMBL23426454 | 0.77 | HRH3 (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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-20210040083-A1 | GCN2 INHIBITORS AND USES THEREOF | MERCK PATENT GMBH (DE) | 2021-02-11 | — | — | US | disclosed |
| US-10793563-B2 | GCN2 inhibitors and uses thereof | MERCK PATENT GMBH (DE) | 2020-10-06 | — | — | US | disclosed |
| US-20190233411-A1 | GCN2 INHIBITORS AND USES THEREOF | MERCK PATENT GMBH (DE) | 2019-08-01 | — | — | US | disclosed |