⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26327464 | 0.83 | POLB (0.36) | — | |
| SCHEMBL6876248 | 0.81 | LMNA (0.33) | — | |
| SCHEMBL9766049 | 0.77 | — | — | |
| SCHEMBL5279 | 0.77 | — | — | |
| SCHEMBL1614803 | 0.74 | — | — | |
| Cyclopentane SCHEMBL9453154 | 0.73 | — | — | |
| SCHEMBL12802725 | 0.73 | — | — | |
| SCHEMBL6243959 | 0.73 | — | — | |
| SCHEMBL18664568 | 0.73 | — | — | |
| SCHEMBL11372758 | 0.73 | — | — |
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-3617204-A1 | INDOLEAMINE 2,3-DIOXYGENASE INHIBITOR AND APPLICATION | Nanjing Transthera Biosciences Co. Ltd. (CN) | 2020-03-04 | — | — | EP | disclosed |