⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2654680 | 0.85 | — | — | |
| SCHEMBL9835957 | 0.80 | — | — | |
| SCHEMBL8589177 | 0.75 | — | — | |
| SCHEMBL8052 | 0.73 | — | — | |
| SCHEMBL10611635 | 0.72 | LTA4H (0.32) | — | |
| SCHEMBL7302488 | 0.69 | — | — | |
| SCHEMBL7625313 | 0.69 | — | — | |
| SCHEMBL16454010 | 0.69 | — | — | |
| SCHEMBL9024964 | 0.69 | — | — | |
| SCHEMBL302347 | 0.68 | HDAC8 (0.37) | — |
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-2217598-A1 | NEW TETRACYCLIC COMPOUNDS | Medivation Technologies, Inc. (US) | 2010-08-18 | — | — | EP | disclosed |
| WO-2009055828-A1 | NEW TETRACYCLIC COMPOUNDS | MEDIVATION TECHNOLOGIES, INC. (US) | 2009-04-30 | — | — | WO | disclosed |