⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL13970945 | 0.82 | CYP1A2 (0.31) | — | |
| SCHEMBL118438 | 0.80 | NUDT1 (0.33) | — | |
| SCHEMBL19088470 | 0.74 | — | — | |
| SCHEMBL17108682 | 0.72 | — | — | |
| SCHEMBL1110558 | 0.71 | — | — | |
| SCHEMBL10626227 | 0.70 | FDPS (0.39) | — | |
| SCHEMBL326787 | 0.69 | — | — | |
| SCHEMBL7619037 | 0.68 | HRH3 (0.34) | — | |
| SCHEMBL7157650 | 0.68 | FDPS (0.50) | — | |
| SCHEMBL10221991 | 0.68 | MEN1 (0.32) | — |
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-20070213340-A1 | Farnesyl protein transferase inhibitors | SCHERING CORPORATION | 2007-09-13 | — | — | US | disclosed |
| WO-2007084498-A1 | PIPERAZINE DERIVATIVES AS FARNESYL PROTEIN TRANSFERASE INHIBITORS | SCHERING CORPORATION (US) | 2007-07-26 | — | — | WO | disclosed |