⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22475127 | 1.00 | — | — | |
| SCHEMBL18801547 | 1.00 | — | — | |
| SCHEMBL25509832 | 1.00 | — | — | |
| SCHEMBL15271486 | 1.00 | — | — | |
| SCHEMBL19190110 | 1.00 | — | — | |
| SCHEMBL12154610 | 1.00 | — | — | |
| SCHEMBL25510293 | 1.00 | — | — | |
| SCHEMBL21754834 | 1.00 | — | — | |
| SCHEMBL13344777 | 0.93 | LGALS3 (0.44) | — | |
| SCHEMBL17072423 | 0.93 | LGALS3 (0.44) | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-2710019-B1 | PROCESSES AND INTERMEDIATES FOR PREPARING ANTI-HIV AGENTS | GILEAD SCIENCES INC (US) | 2017-05-03 | — | — | EP | disclosed |