⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14608873 | 0.72 | — | — | |
| SCHEMBL13771181 | 0.71 | MEN1 (0.34) | — | |
| SCHEMBL12806497 | 0.71 | — | — | |
| SCHEMBL8353046 | 0.71 | — | — | |
| SCHEMBL22210998 | 0.59 | HTR2A (0.31) | — | |
| SCHEMBL283057 | 0.59 | — | — | |
| SCHEMBL13772830 | 0.57 | MEN1 (0.33) | — | |
| SCHEMBL14260036 | 0.56 | — | — | |
| SCHEMBL19171027 | 0.56 | — | — | |
| SCHEMBL15905705 | 0.56 | CYP3A4 (0.36) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011023677-A1 | TETRA-SUBSTITUTED HETEROARYL COMPOUNDS AND THEIR USE AS MDM2 AND/OR MDM4 MODULATORS | NOVARTIS AG (CH) | 2011-03-03 | — | — | WO | disclosed |