⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL130690 | 0.78 | — | — | |
| SCHEMBL15469439 | 0.78 | — | — | |
| SCHEMBL30535283 | 0.74 | LMNA (0.82) | — | |
| SCHEMBL676142 | 0.74 | LMNA (0.82) | — | |
| SCHEMBL4808799 | 0.74 | CHRNB2 (0.51) | — | |
| Potassium SCHEMBL6776357 | 0.72 | LMNA (0.78) | — | |
| SCHEMBL5496085 | 0.72 | — | — | |
| Ethyne SCHEMBL27176503 | 0.71 | KMT2A (0.54) | — | |
| SCHEMBL427752 | 0.71 | CYP19A1 (0.44) | — | |
| SCHEMBL11498995 | 0.71 | LMNA (0.43) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0766664-B1 | METALLOPROTEINASE INHIBITORS | BRITISH BIOTECH PHARM (GB) | 2000-04-05 | — | — | EP | claimed |
| CN-100345823-C | Compounds, compositions and methods | CYTOKINETICS INC (US) | 2007-10-31 | — | — | CN | disclosed |
| CN-1738793-A | Compounds, compositions and methods | CYTOKINETICS INC (US) | 2006-02-22 | — | — | CN | disclosed |