⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2737429 | 1.00 | — | — | |
| SCHEMBL22962141 | 1.00 | — | — | |
| SCHEMBL19084876 | 1.00 | — | — | |
| SCHEMBL2737390 | 1.00 | — | — | |
| SCHEMBL18969351 | 0.84 | — | — | |
| SCHEMBL21718426 | 0.84 | — | — | |
| SCHEMBL18969347 | 0.84 | — | — | |
| SCHEMBL18969299 | 0.84 | — | — | |
| SCHEMBL18969346 | 0.84 | — | — | |
| SCHEMBL18968190 | 0.84 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2022140428-A2 | INHIBITORS OF PEPTIDYLARGININE DEIMINASES | GILEAD SCIENCES, INC. (US) | 2022-06-30 | — | — | WO | disclosed |
| US-10865216-B2 | Tricyclic Gyrase inhibitors | MERCK SHARP & DOHME CORP. (US) | 2020-12-15 | — | — | US | disclosed |