⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14599696 | 0.89 | FFAR1 (0.35) | — | |
| SCHEMBL14599694 | 0.87 | F9 (0.37) | — | |
| SCHEMBL14599692 | 0.74 | FFAR1 (0.38) | — | |
| SCHEMBL14599693 | 0.73 | F9 (0.36) | — | |
| SCHEMBL14629716 | 0.61 | F9 (0.43) | — | |
| SCHEMBL14599677 | 0.61 | L3MBTL1 (0.38) | — | |
| SCHEMBL14599698 | 0.61 | FFAR1 (0.39) | — | |
| SCHEMBL14599686 | 0.61 | TDP1 (0.36) | — | |
| SCHEMBL31169674 | 0.61 | TERT (0.50) | — | |
| SCHEMBL14599679 | 0.60 | STAT3 (0.39) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20070015742-A1 | Porphyrin derivatives | YAHIOGLU GOKHAN | 2007-01-18 | — | — | US | disclosed |