⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL5454572 | 0.78 | CRBN (0.36) | — | |
| SCHEMBL3392904 | 0.78 | LMNA (0.40) | — | |
| SCHEMBL11557958 | 0.78 | CRBN (0.36) | — | |
| SCHEMBL12534400 | 0.75 | ATM (0.40) | — | |
| SCHEMBL6039283 | 0.74 | — | — | |
| SCHEMBL23936809 | 0.73 | — | — | |
| SCHEMBL27408849 | 0.73 | — | — | |
| SCHEMBL10554738 | 0.73 | — | — | |
| SCHEMBL22951044 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL6044878 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0025233-A1 | Method for purification of 6-(D-2-(D-2-amino-3-N-methylcarbamoylpropionamido)-2-p-hydroxyphenylacetamido)-penicillanic acid | Tanabe Seiyaku Co., Ltd. (JP) | 1981-03-18 | — | — | EP | disclosed |