⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL25847794 | 0.65 | — | — | |
| SCHEMBL2044859 | 0.63 | — | — | |
| SCHEMBL19966092 | 0.61 | — | — | |
| SCHEMBL19250624 | 0.56 | — | — | |
| SCHEMBL14378567 | 0.55 | HTR5A (0.35) | — | |
| SCHEMBL25949562 | 0.54 | UHRF1 (0.40) | — | |
| SCHEMBL17606952 | 0.54 | — | — | |
| SCHEMBL279520 | 0.53 | — | — | |
| SCHEMBL16421169 | 0.53 | — | — | |
| SCHEMBL10201047 | 0.51 | — | — |
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-2046799-B1 | PHOSPHOINOSITIDE 3-KINASE INHIBITOR COMPOUNDS AND PHARMACEUTICAL COMPOSITIONS CONTAINING THEM | GENENTECH INC (US) | 2017-07-19 | — | — | EP | disclosed |