⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8865047 | 0.94 | — | — | |
| SCHEMBL8864457 | 0.91 | FPR1 (0.30) | — | |
| SCHEMBL8864247 | 0.90 | FPR1 (0.30) | — | |
| SCHEMBL8864331 | 0.88 | FPR1 (0.31) | — | |
| SCHEMBL8864488 | 0.86 | — | — | |
| SCHEMBL8864310 | 0.85 | MEN1 (0.30) | — | |
| SCHEMBL8864292 | 0.80 | SLC6A2 (0.32) | — | |
| SCHEMBL8864523 | 0.80 | FPR1 (0.32) | — | |
| SCHEMBL8864383 | 0.78 | — | — | |
| SCHEMBL8864415 | 0.75 | SLC6A2 (0.32) | — |
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-5633239-A | CARDIOVASCULAR DISORDERS; HYPOGLYCEMIC AGENTS | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-05-27 | — | — | US | disclosed |