⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL6812902 | 0.73 | MEN1 (0.30) | — | |
| SCHEMBL17469999 | 0.65 | MEN1 (0.34) | — | |
| Hydrochloric Acid SCHEMBL7207590 | 0.64 | — | — | |
| SCHEMBL16326525 | 0.64 | — | — | |
| SCHEMBL5829698 | 0.62 | — | — | |
| SCHEMBL7638710 | 0.60 | — | — | |
| SCHEMBL8374668 | 0.59 | — | — | |
| SCHEMBL28079451 | 0.59 | — | — | |
| SCHEMBL9224200 | 0.59 | — | — | |
| SCHEMBL7930499 | 0.58 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| EP-0859798-B1 | CATALYST SYSTEM | TARGOR GMBH (DE) | 2001-01-31 | — | — | EP | disclosed |
| EP-0859798-A1 | CATALYST SYSTEM | TARGOR GmbH (DE) | 1998-08-26 | — | — | EP | disclosed |
| WO-1998007760-A1 | CATALYST SYSTEM | TARGOR GMBH (DE) | 1998-02-26 | — | — | WO | disclosed |