⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14785130 | 0.80 | — | — | |
| SCHEMBL9358135 | 0.80 | — | — | |
| SCHEMBL3342425 | 0.72 | — | — | |
| SCHEMBL28351780 | 0.67 | — | — | |
| SCHEMBL4884379 | 0.67 | — | — | |
| SCHEMBL4136640 | 0.65 | — | — | |
| SCHEMBL11568465 | 0.60 | — | — | |
| SCHEMBL28988496 | 0.60 | — | — | |
| SCHEMBL5788268 | 0.60 | — | — | |
| SCHEMBL9631271 | 0.60 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0025602-A1 | Acylated cephalosporin analogs, process for their preparation and pharmaceutical compositions comprising them | KYOWA HAKKO KOGYO CO., LTD (JP) | 1981-03-25 | — | — | EP | disclosed |
| EP-0014402-A1 | Novel 20-0-acylmaytansinoids, process for their preparation and pharmaceutical compositions containing them | Takeda Chemical Industries, Ltd. (JP) | 1980-08-20 | — | — | EP | disclosed |