⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL788769 | 0.83 | KMT2A (0.53) | — | |
| SCHEMBL11938132 | 0.80 | KMT2A (0.50) | — | |
| SCHEMBL15147841 | 0.78 | KMT2A (0.41) | — | |
| SCHEMBL5497199 | 0.76 | — | — | |
| SCHEMBL11719619 | 0.75 | — | — | |
| SCHEMBL10024581 | 0.74 | — | — | |
| SCHEMBL1106831 | 0.74 | — | — | |
| SCHEMBL1106829 | 0.74 | LMNA (0.74) | — | |
| SCHEMBL1073709 | 0.74 | — | — | |
| SCHEMBL9287637 | 0.73 | — | — |
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-4053318-A | SENSITIZING MEROCYANINE DYE | FUJI PHOTO FILM CO., LTD. (JA) | 1977-10-11 | — | — | US | disclosed |