⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16889120 | 1.00 | — | — | |
| SCHEMBL2284513 | 1.00 | — | — | |
| SCHEMBL2832007 | 0.81 | — | — | |
| SCHEMBL16553644 | 0.81 | — | — | |
| SCHEMBL16885277 | 0.78 | PIK3CD (0.33) | — | |
| SCHEMBL16986044 | 0.78 | CHRNA7 (0.31) | — | |
| SCHEMBL17037488 | 0.78 | PIK3CD (0.33) | — | |
| SCHEMBL16885275 | 0.78 | PIK3CD (0.33) | — | |
| SCHEMBL4456045 | 0.76 | CHRNA7 (0.34) | — | |
| SCHEMBL18595227 | 0.75 | PDE4B (0.33) | — |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-9586931-B2 | Triazolyl derivatives as Syk inhibitors | MERCK SHARP & DOHME CORP. (US) | 2017-03-07 | — | — | US | disclosed |
| US-20150239866-A1 | TRIAZOLYL DERIVATIVES AS SYK INHIBITORS | MERCK CANADA INC. (CA) | 2015-08-27 | — | — | US | disclosed |
| US-20090184062-A1 | METHOD FOR INHIBITING BIOFILM GROWTH | PPG INDUSTRIES OHIO, INC. (US) | 2009-07-23 | — | — | US | disclosed |