⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL9862168 | 1.00 | — | — | |
| SCHEMBL2197998 | 0.78 | TDP1 (0.31) | — | |
| SCHEMBL14950 | 0.72 | — | — | |
| SCHEMBL7193592 | 0.72 | LMNA (0.37) | — | |
| SCHEMBL14952 | 0.72 | — | — | |
| SCHEMBL2487818 | 0.72 | LMNA (0.37) | — | |
| SCHEMBL471874 | 0.70 | — | — | |
| SCHEMBL4347745 | 0.70 | — | — | |
| SCHEMBL1345206 | 0.70 | — | — | |
| SCHEMBL11134868 | 0.70 | — | — |
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-4981913-A | SHELF LIFE, PAPERMAKING | BASF AKTIENGESELLSCHAFT (DE) | 1991-01-01 | — | — | US | disclosed |