⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21435034 | 0.86 | MAP4K1 (0.32) | — | |
| SCHEMBL21434991 | 0.84 | — | — | |
| SCHEMBL21435100 | 0.81 | — | — | |
| SCHEMBL21453201 | 0.76 | HPGDS (0.41) | — | |
| SCHEMBL21435054 | 0.72 | — | — | |
| SCHEMBL21435151 | 0.68 | ALDH1A1 (0.36) | — | |
| SCHEMBL21435069 | 0.67 | — | — | |
| SCHEMBL21435099 | 0.63 | ALDH1A1 (0.35) | — | |
| SCHEMBL21453308 | 0.61 | CSF1R (0.37) | — | |
| SCHEMBL22803238 | 0.60 | ADORA1 (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-2019195846-A1 | IMIDAZOPIPERAZINONE INHIBITORS OF TRANSCRIPTION ACTIVATING PROTEINS | BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM (US) | 2019-10-10 | — | — | WO | disclosed |