⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12406689 | 1.00 | — | — | |
| SCHEMBL19271674 | 1.00 | — | — | |
| SCHEMBL22198336 | 0.78 | TDP1 (0.33) | — | |
| SCHEMBL20117452 | 0.71 | — | — | |
| SCHEMBL15944225 | 0.71 | — | — | |
| SCHEMBL22476004 | 0.71 | — | — | |
| SCHEMBL17874213 | 0.69 | — | — | |
| SCHEMBL15772520 | 0.69 | — | — | |
| SCHEMBL614073 | 0.69 | — | — | |
| SCHEMBL14722116 | 0.69 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2010009124-A2 | ANTHRACYCLINE DERIVATIVE CONJUGATES, PROCESS FOR THEIR PREPARATION AND THEIR USE AS ANTITUMOR COMPOUNDS | GENENTECH, INC. (US) | 2010-01-21 | — | — | WO | disclosed |