⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21451767 | 0.80 | PTGDR2 (0.32) | — | |
| SCHEMBL25616371 | 0.61 | CSNK2A1 (0.33) | — | |
| SCHEMBL30071117 | 0.60 | RET (0.41) | — | |
| SCHEMBL1483040 | 0.60 | RET (0.41) | — | |
| SCHEMBL29897212 | 0.60 | RET (0.53) | — | |
| SCHEMBL16517502 | 0.60 | LRRK2 (0.38) | — | |
| SCHEMBL21451933 | 0.59 | HDAC6 (0.33) | — | |
| SCHEMBL9535041 | 0.57 | KDM4E (0.43) | — | |
| SCHEMBL13966386 | 0.55 | LRRK2 (0.42) | — | |
| SCHEMBL22440558 | 0.54 | KDM4E (0.39) | — |
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-10918645-B2 | Substituted tricyclic heterocyclic compounds and use thereof | LIFEARC (GB) | 2021-02-16 | — | — | US | disclosed |
| US-20190307763-A1 | SUBSTITUTED TRICYCLIC HETEROCYCLIC COMPOUNDS AND USE THEREOF | LIFEARC (GB) | 2019-10-10 | — | — | US | disclosed |