⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14864644 | 0.76 | GAA (0.39) | — | |
| SCHEMBL9965751 | 0.75 | — | — | |
| SCHEMBL3823010 | 0.74 | RAB9A (0.44) | — | |
| Hydrochloric Acid SCHEMBL10668153 | 0.73 | KMT2A (0.54) | — | |
| SCHEMBL18774053 | 0.71 | — | — | |
| SCHEMBL10344902 | 0.69 | ALDH1A1 (0.41) | — | |
| SCHEMBL3375995 | 0.69 | — | — | |
| SCHEMBL2611831 | 0.69 | — | — | |
| SCHEMBL23497255 | 0.69 | KMT2A (0.44) | — | |
| SCHEMBL19457067 | 0.68 | TMIGD3 (0.51) | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2007065288-A2 | USEFUL COMBINATIONS OF MONOBACTAM ANTIBIOTICS WITH BETA-LACTAMASE INHIBITORS | BASILEA PHARMACEUTICA AG (CH) | 2007-06-14 | — | — | WO | disclosed |