⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17927910 | 0.80 | — | — | |
| SCHEMBL23205698 | 0.79 | — | — | |
| SCHEMBL17576929 | 0.73 | — | — | |
| SCHEMBL1937422 | 0.71 | — | — | |
| SCHEMBL17972718 | 0.71 | — | — | |
| SCHEMBL20953694 | 0.68 | PRMT3 (0.37) | — | |
| SCHEMBL22800319 | 0.68 | — | — | |
| SCHEMBL21965333 | 0.67 | — | — | |
| SCHEMBL13432818 | 0.67 | — | — | |
| SCHEMBL21396360 | 0.65 | — | — |
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-20170183365-A1 | MACROCYCLES | LUMIPHORE, INC. | 2017-06-29 | — | — | US | disclosed |
| US-20160221971-A1 | DI-MACROCYCLES | LUMIPHORE, INC. (US) | 2016-08-04 | — | — | US | disclosed |