⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL8569383 | 0.79 | — | — | |
| SCHEMBL8163345 | 0.67 | — | — | |
| SCHEMBL7930499 | 0.66 | — | — | |
| Hydrochloric Acid SCHEMBL7544071 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL6817559 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL29205534 | 0.64 | — | — | |
| Hydrochloric Acid SCHEMBL2240395 | 0.63 | — | — | |
| SCHEMBL8574939 | 0.60 | CASR (0.30) | — | |
| Hydrochloric Acid SCHEMBL29205560 | 0.60 | — | — | |
| SCHEMBL9998128 | 0.59 | — | — |
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 |