⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2918343 | 0.82 | — | — | |
| SCHEMBL5134 | 0.78 | — | — | |
| SCHEMBL2920367 | 0.78 | GLI1 (0.42) | — | |
| SCHEMBL2919953 | 0.78 | CHRNB2 (0.32) | — | |
| SCHEMBL6496900 | 0.78 | KMT2A (0.33) | — | |
| SCHEMBL6199643 | 0.72 | PRCP (0.37) | — | |
| SCHEMBL8860980 | 0.71 | PRCP (0.50) | — | |
| SCHEMBL11990777 | 0.71 | — | — | |
| SCHEMBL8078711 | 0.71 | — | — | |
| SCHEMBL6292949 | 0.71 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-7718657-B2 | Certain indanyl urea modulators of the cardiac sarcomere | CYTOKINETICS, INC. (US) | 2010-05-18 | — | — | US | disclosed |
| US-20070197507-A1 | Certain chemical entities, compositions and methods | CYTOKINETICS, INC. | 2007-08-23 | — | — | US | disclosed |