⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16378643 | 0.75 | — | — | |
| SCHEMBL28087752 | 0.73 | — | — | |
| SCHEMBL8847078 | 0.72 | LMNA (0.41) | — | |
| SCHEMBL28023685 | 0.71 | — | — | |
| SCHEMBL25722 | 0.69 | THRB (0.44) | — | |
| SCHEMBL22654527 | 0.69 | THRB (0.44) | — | |
| SCHEMBL1441283 | 0.67 | — | — | |
| SCHEMBL5442524 | 0.67 | THRB (0.36) | — | |
| Ammonia Solution, Strong SCHEMBL1425644 | 0.67 | THRB (0.42) | — | |
| SCHEMBL3315438 | 0.67 | — | — |
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-2001046287-A1 | INTEGRATED CONTINUOUS PROCESS FOR UPSTAGING EPOXY RESINS | RESOLUTION RESEARCH NEDERLAND B.V. (NL) | 2001-06-28 | — | — | WO | disclosed |