⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7565754 | 0.68 | — | — | |
| SCHEMBL170456 | 0.66 | PLAU (0.43) | — | |
| SCHEMBL29504825 | 0.66 | PLAU (0.43) | — | |
| SCHEMBL4513586 | 0.66 | TSHR (0.31) | — | |
| SCHEMBL4848367 | 0.66 | — | — | |
| SCHEMBL31312839 | 0.64 | PLAU (0.42) | — | |
| SCHEMBL8827973 | 0.64 | PLAU (0.42) | — | |
| Hydrochloric Acid SCHEMBL10824104 | 0.64 | PLAU (0.42) | — | |
| SCHEMBL277639 | 0.64 | — | — | |
| SCHEMBL107331 | 0.63 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2002069972-A2 | TRIAZOLE COMPOUNDS AND THE USE THEREOF IN THE PROPHYLAXIS AND THERAPY OF NEURODEGENERATIVE DISEASES, CEREBRAL TRAUMA AND CEREBRAL ISCHEMIA | ABBOTT GMBH & CO. KG (DE) | 2002-09-12 | — | — | WO | claimed |
| WO-2002069972-A2 | TRIAZOLE COMPOUNDS AND THE USE THEREOF IN THE PROPHYLAXIS AND THERAPY OF NEURODEGENERATIVE DISEASES, CEREBRAL TRAUMA AND CEREBRAL ISCHEMIA | ABBOTT GMBH & CO. KG (DE) | 2002-09-12 | — | — | WO | disclosed |
| US-5049560-A | Anticoagulants, platelet activating factor | SOCIETE DE CONSEILS DE RECHERCHES ET D'APPLICATIONS SCIENTIFIQUES (S.C.R.A.S.) (FR) | 1991-09-17 | — | — | US | disclosed |