⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9826257 | 0.82 | CRBN (0.33) | — | |
| SCHEMBL19860007 | 0.69 | ALDH1A1 (0.30) | — | |
| SCHEMBL18545242 | 0.63 | MAP3K14 (0.33) | — | |
| SCHEMBL5390017 | 0.63 | — | — | |
| SCHEMBL455753 | 0.63 | — | — | |
| SCHEMBL3628793 | 0.63 | MAP3K14 (0.33) | — | |
| SCHEMBL20827756 | 0.63 | MAP3K14 (0.33) | — | |
| SCHEMBL5390855 | 0.59 | MAP3K14 (0.36) | — | |
| SCHEMBL9463682 | 0.59 | CRBN (0.39) | — | |
| SCHEMBL431589 | 0.59 | — | — |
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-0969842-A1 | PHARMACEUTICAL COMPOSITION | R.P. Scherer Limited (GB) | 2000-01-12 | — | — | EP | disclosed |
| WO-1998042344-A1 | PHARMACEUTICAL COMPOSITION | R. P. SCHERER LIMITED (GB) | 1998-10-01 | — | — | WO | disclosed |