⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL11420286 | 1.00 | — | — | |
| SCHEMBL10943545 | 0.88 | KDM4E (0.31) | — | |
| SCHEMBL10943549 | 0.88 | KDM4E (0.31) | — | |
| SCHEMBL11165414 | 0.87 | — | — | |
| SCHEMBL19852932 | 0.87 | DGAT2 (0.37) | — | |
| SCHEMBL11428285 | 0.87 | — | — | |
| SCHEMBL11165388 | 0.87 | — | — | |
| SCHEMBL11414378 | 0.87 | DGAT2 (0.37) | — | |
| SCHEMBL11039306 | 0.87 | ASGR1 (0.33) | — | |
| SCHEMBL11153114 | 0.87 | DGAT2 (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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4183919-A | 4'-O-METHYLDAUNOMYCIN AND 4'-O-METHYLADRIAMYCIN, LEUKEMIA INHIBITION | FARMITALIA CARLO ERBA S.P.A. (IT) | 1980-01-15 | — | — | US | disclosed |