⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL681519 | 0.87 | — | — | |
| SCHEMBL115533 | 0.87 | — | — | |
| SCHEMBL3722018 | 0.87 | — | — | |
| SCHEMBL6718961 | 0.84 | — | — | |
| SCHEMBL10729300 | 0.84 | — | — | |
| SCHEMBL3116714 | 0.84 | — | — | |
| SCHEMBL77661 | 0.84 | — | — | |
| SCHEMBL7240256 | 0.81 | — | — | |
| SCHEMBL643771 | 0.81 | — | — | |
| SCHEMBL11689099 | 0.78 | — | — |
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-1998008813-A1 | COMBINATORIAL PROCESS FOR PREPARING SUBSTITUTED PYRROLIDINE LIBRARIES | ELI LILLY AND COMPANY (US) | 1998-03-05 | — | — | WO | disclosed |