⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL28177248 | 0.77 | CA1 (0.34) | — | |
| SCHEMBL6860113 | 0.75 | — | — | |
| SCHEMBL23714918 | 0.75 | — | — | |
| SCHEMBL7723602 | 0.75 | — | — | |
| SCHEMBL5490414 | 0.75 | — | — | |
| SCHEMBL7127672 | 0.73 | GAA (0.42) | — | |
| SCHEMBL5213000 | 0.71 | GABRA5 (0.53) | — | |
| SCHEMBL77452 | 0.71 | CCR4 (0.51) | — | |
| SCHEMBL8556549 | 0.71 | L3MBTL1 (0.59) | — | |
| SCHEMBL91576 | 0.71 | SMN1; SMN2 (0.40) | — |
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-0796263-A1 | CEPHEM COMPOUNDS AND PHARMACEUTICAL USE THEREOF | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1997-09-24 | — | — | EP | disclosed |
| WO-1996017850-A1 | CEPHEM COMPOUNDS AND PHARMACEUTICAL USE THEREOF | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 1996-06-13 | — | — | WO | disclosed |