⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7823646 | 0.96 | TRIM24 (1.00) | — | |
| Cyclohexanone SCHEMBL713141 | 0.96 | — | — | |
| Cyclohexanone SCHEMBL386409 | 0.96 | TRIM24 (1.00) | — | |
| SCHEMBL1667004 | 0.96 | TRIM24 (1.00) | — | |
| SCHEMBL21403465 | 0.96 | TRIM24 (1.00) | — | |
| SCHEMBL25380098 | 0.96 | TRIM24 (1.00) | — | |
| Cyclohexanone SCHEMBL3299 | 0.96 | — | — | |
| Cycloheptanone SCHEMBL6077 | 0.96 | — | — | |
| SCHEMBL112034 | 0.96 | TRIM24 (1.00) | — | |
| SCHEMBL3396727 | 0.96 | TRIM24 (1.00) | — |
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-2596509-A2 | DYE SOLAR CELL WITH IMPROVED STABILITY | BASF SE (DE) | 2013-05-29 | — | — | EP | disclosed |
| WO-2012011023-A2 | DYE SOLAR CELL WITH IMPROVED STABILITY | BASF SE (DE) | 2012-01-26 | — | — | WO | disclosed |