⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL20717738 | 1.00 | — | — | |
| SCHEMBL19115938 | 1.00 | — | — | |
| SCHEMBL169096 | 0.85 | SLC15A1 (0.58) | — | |
| SCHEMBL10954322 | 0.84 | DPP4 (0.47) | — | |
| SCHEMBL29616779 | 0.79 | DPP4 (0.48) | — | |
| SCHEMBL23691240 | 0.78 | — | — | |
| Diacetamide SCHEMBL19614390 | 0.78 | CRBN (0.46) | — | |
| SCHEMBL9115106 | 0.78 | — | — | |
| SCHEMBL29634918 | 0.78 | — | — | |
| SCHEMBL15385288 | 0.78 | — | — |
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-2022106611-A1 | NOVEL COMPOSITIONS OF BETA-LACTAM COMPOUNDS | XELLIA PHARMACEUTICALS APS (DK) | 2022-05-27 | — | — | WO | disclosed |
| WO-2022106630-A1 | STABLE FORMULATIONS COMPRISING PIPERACILLIN AND/OR TAZOBACTAM | XELLIA PHARMACEUTICALS APS (DK) | 2022-05-27 | — | — | WO | disclosed |