⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22750824 | 0.70 | — | — | |
| SCHEMBL20095094 | 0.67 | LMNA (0.39) | — | |
| SCHEMBL8843999 | 0.63 | POLB (0.50) | — | |
| SCHEMBL19736455 | 0.62 | LMNA (0.42) | — | |
| SCHEMBL15020344 | 0.61 | LMNA (0.45) | — | |
| SCHEMBL2443374 | 0.61 | — | — | |
| SCHEMBL8685787 | 0.58 | ALDH1A1 (0.31) | — | |
| SCHEMBL75716 | 0.57 | — | — | |
| SCHEMBL7191810 | 0.57 | ALDH1A1 (0.62) | — | |
| SCHEMBL2869460 | 0.56 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5663164-A | CEPHALOSPORIN ANTIBIOTICS AS BACTERICIDES | ROUSSEL UCLAF (FR) | 1997-09-02 | — | — | US | claimed |
| US-5663164-A | CEPHALOSPORIN ANTIBIOTICS AS BACTERICIDES | ROUSSEL UCLAF (FR) | 1997-09-02 | — | — | US | disclosed |