⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6697299 | 0.74 | F2RL1 (0.34) | — | |
| SCHEMBL3640176 | 0.70 | — | — | |
| SCHEMBL3638093 | 0.70 | — | — | |
| SCHEMBL10457318 | 0.61 | HSD17B10 (0.33) | — | |
| SCHEMBL7426721 | 0.60 | — | — | |
| SCHEMBL25407480 | 0.60 | — | — | |
| SCHEMBL25257845 | 0.59 | — | — | |
| SCHEMBL18989643 | 0.59 | — | — | |
| SCHEMBL15233191 | 0.58 | HSD17B10 (0.32) | — | |
| SCHEMBL9978972 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-1358165-A1 | IMIDAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2003-11-05 | — | — | EP | disclosed |
| WO-2002060877-A1 | IMIDAZOLE DERIVATIVES | F. HOFFMANN-LA ROCHE AG (CH) | 2002-08-08 | — | — | WO | disclosed |