⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25925947 | 0.83 | — | — | |
| SCHEMBL25926006 | 0.78 | — | — | |
| SCHEMBL25930230 | 0.71 | MEN1 (0.31) | — | |
| SCHEMBL25925817 | 0.70 | KMT2A (0.32) | — | |
| SCHEMBL25926067 | 0.68 | KCNH2 (0.45) | — | |
| SCHEMBL25925807 | 0.68 | — | — | |
| SCHEMBL25926010 | 0.66 | — | — | |
| SCHEMBL15049291 | 0.66 | PIM1 (0.40) | — | |
| SCHEMBL15049290 | 0.66 | PIM1 (0.40) | — | |
| SCHEMBL25925798 | 0.66 | — | — |
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-20230242523-A1 | COMPOUND, TAUTOMER OF COMPOUND OR SALT OF COMPOUND OR TAUTOMER, METHOD FOR PRODUCING SAME, COLORING COMPOSITION, DYEING METHOD, AND DYED ARTICLE | FUJIFILM CORPORATION (JP) | 2023-08-03 | — | — | US | disclosed |