⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9915284 | 0.69 | KDM4E (0.31) | — | |
| SCHEMBL24504589 | 0.65 | — | — | |
| SCHEMBL24861474 | 0.62 | CHEK1 (0.38) | — | |
| SCHEMBL409307 | 0.57 | — | — | |
| SCHEMBL18708861 | 0.56 | CYP1A2 (0.31) | — | |
| SCHEMBL1132433 | 0.55 | — | — | |
| SCHEMBL19412772 | 0.55 | JAK2 (0.40) | — | |
| SCHEMBL15147444 | 0.54 | — | — | |
| SCHEMBL25403717 | 0.54 | — | — | |
| SCHEMBL25476740 | 0.53 | KDM4E (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1313751-B1 | NEW MACROLIDES WITH ANTIBACTERIAL ACTIVITY | BASILEA PHARMACEUTICA AG (CH) | 2008-09-17 | — | — | EP | disclosed |