⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1682464 | 0.69 | — | — | |
| SCHEMBL4650431 | 0.69 | — | — | |
| SCHEMBL3067726 | 0.69 | — | — | |
| SCHEMBL1486034 | 0.69 | — | — | |
| SCHEMBL13529922 | 0.67 | — | — | |
| Hydrochloric Acid SCHEMBL3174913 | 0.67 | — | — | |
| SCHEMBL14426302 | 0.64 | — | — | |
| SCHEMBL1706297 | 0.64 | — | — | |
| Carboxymethoxylamine SCHEMBL98144 | 0.64 | — | — | |
| SCHEMBL491178 | 0.62 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015188934-A1 | CONJUGATE COMPRISING A NEUROTENSIN RECEPTOR LIGAND AND USE THEREOF | 3B PHARMACEUTICALS GMBH (DE) | 2015-12-17 | — | — | WO | disclosed |
| WO-2012052843-A1 | POCHOXIME CONJUGATES USEFUL FOR THE TREATMENT OF HSP90 RELATED PATHOLOGIES | UNIVERSITE DE STRASBOURG (FR) | 2012-04-26 | — | — | WO | disclosed |
| US-4404384-A | HYPOTENSIVE, ANTISPASMODIC, CHOLERETIC AGENTS; ANTICONUULSANTS; ANTIPYRETICS; ANTHELMINTICS; FUNGICIDWS | HOECHST AKTIENGESELLSCHAFT (DE) | 1983-09-13 | — | — | US | disclosed |
| US-4150043-A | 0-(2,3-Epoxypropyl)-hydroximic acid esters | HOECHST AKTIENGESELLSCHAFT (DE) | 1979-04-17 | — | — | US | disclosed |