⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2602380 | 0.86 | HPGD (0.34) | — | |
| SCHEMBL21453411 | 0.74 | HTT (0.31) | — | |
| SCHEMBL19696537 | 0.72 | — | — | |
| SCHEMBL18235355 | 0.72 | — | — | |
| SCHEMBL14124516 | 0.70 | KDM4E (0.31) | — | |
| SCHEMBL1106106 | 0.70 | HPGD (0.30) | — | |
| SCHEMBL18235328 | 0.70 | CA2 (0.37) | — | |
| SCHEMBL18235329 | 0.70 | PLCG1 (0.35) | — | |
| SCHEMBL21969672 | 0.70 | — | — | |
| SCHEMBL24499244 | 0.68 | — | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9840503-B2 | Heterocyclic compounds and uses thereof | INCYTE CORPORATION (US) | 2017-12-12 | — | — | US | disclosed |
| US-20160333008-A1 | HETEROCYCLIC COMPOUNDS AND USES THEREOF | INCYTE CORPORATION | 2016-11-17 | — | — | US | disclosed |