⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2047187 | 0.72 | — | — | |
| SCHEMBL1105725 | 0.61 | — | — | |
| SCHEMBL24511041 | 0.59 | — | — | |
| SCHEMBL20218599 | 0.58 | — | — | |
| SCHEMBL13721181 | 0.57 | — | — | |
| SCHEMBL10067437 | 0.57 | MEN1 (0.37) | — | |
| SCHEMBL16422203 | 0.55 | — | — | |
| SCHEMBL11957633 | 0.54 | — | — | |
| SCHEMBL20182819 | 0.53 | — | — | |
| SCHEMBL23839818 | 0.53 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-20150031709-A1 | Heteroaryl Compounds and Methods of Use Thereof | SUNOVION PHARMACEUTICALS, INC. (US) | 2015-01-29 | — | — | US | disclosed |