⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12690423 | 0.64 | — | — | |
| SCHEMBL2560987 | 0.64 | — | — | |
| SCHEMBL12949560 | 0.63 | TYR (0.61) | — | |
| SCHEMBL19504430 | 0.62 | GAA (0.41) | — | |
| SCHEMBL20456688 | 0.62 | LRRK2 (0.32) | — | |
| SCHEMBL12610063 | 0.62 | ALDH1A1 (0.51) | — | |
| SCHEMBL16427332 | 0.62 | MEN1 (0.33) | — | |
| SCHEMBL12726643 | 0.59 | SMN1; SMN2 (0.36) | — | |
| SCHEMBL17395216 | 0.59 | LRRK2 (0.33) | — | |
| SCHEMBL31546987 | 0.54 | MGAM (0.31) | — |
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-0227953-B1 | NEW CEPHALOSPORIN DERIVATIVES AND ANTIBIOTICS CONTAINING THE SAME | MEIJI SEIKA KAISHA LTD. (JP) | 1993-02-03 | — | — | EP | disclosed |
| US-4898858-A | Cephalosporin derivatives and antibiotics containing the same | MEIJI SEIKA KAISHA LTD. (JP) | 1990-02-06 | — | — | US | disclosed |