⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL18834629 | 0.59 | — | — | |
| SCHEMBL18752615 | 0.59 | — | — | |
| SCHEMBL13377559 | 0.53 | — | — | |
| SCHEMBL15692585 | 0.53 | — | — | |
| SCHEMBL2045462 | 0.52 | — | — | |
| SCHEMBL19366436 | 0.51 | — | — | |
| SCHEMBL27635184 | 0.47 | — | — | |
| SCHEMBL13697567 | 0.45 | — | — | |
| SCHEMBL2998374 | 0.43 | — | — | |
| SCHEMBL3117258 | 0.43 | — | — |
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-3039020-B1 | IDO INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2017-07-19 | — | — | EP | disclosed |