⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3886965 | 0.79 | — | — | |
| SCHEMBL23776915 | 0.77 | — | — | |
| Hydrochloric Acid SCHEMBL5463903 | 0.77 | OPRM1 (0.36) | — | |
| SCHEMBL19274943 | 0.75 | — | — | |
| SCHEMBL12391772 | 0.75 | — | — | |
| SCHEMBL1062479 | 0.75 | OPRM1 (0.40) | — | |
| SCHEMBL28949342 | 0.73 | — | — | |
| SCHEMBL28650520 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL9358981 | 0.73 | OPRM1 (0.38) | — | |
| Hydrochloric Acid SCHEMBL1443094 | 0.73 | OPRM1 (0.39) | — |
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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| JP-2008526901-A | — | — | 2008-07-24 | — | — | JP | claimed |
| EP-1838719-A1 | PROCESS FOR THE MANUFACTURE OF AMINOALKYLENEPHOSPHONIC ACID COMPOUNDS IN THE PRESENCE OF A HETEROGENEOUS CATALYST | Thermphos Trading GmbH (CH) | 2007-10-03 | — | — | EP | claimed |
| WO-2006074730-A1 | PROCESS FOR THE MANUFACTURE OF AMINOALKYLENEPHOSPHONIC ACID COMPOUNDS IN THE PRESENCE OF A HETEROGENEOUS CATALYST | THERMPHOS TRADING GMBH (CH) | 2006-07-20 | — | — | WO | claimed |
| EP-1838720-A1 | PROCESS FOR THE MANUFACTURE OF AMINOPOLYALKYLENEPHOSPHONIC ACID COMPOUNDS | Thermphos Trading GmbH (CH) | 2007-10-03 | — | — | EP | disclosed |
| EP-1838719-A1 | PROCESS FOR THE MANUFACTURE OF AMINOALKYLENEPHOSPHONIC ACID COMPOUNDS IN THE PRESENCE OF A HETEROGENEOUS CATALYST | Thermphos Trading GmbH (CH) | 2007-10-03 | — | — | EP | disclosed |
| WO-2006074730-A1 | PROCESS FOR THE MANUFACTURE OF AMINOALKYLENEPHOSPHONIC ACID COMPOUNDS IN THE PRESENCE OF A HETEROGENEOUS CATALYST | THERMPHOS TRADING GMBH (CH) | 2006-07-20 | — | — | WO | disclosed |
| WO-2006074729-A1 | PROCESS FOR THE MANUFACTURE OF AMINOPOLYALKYLENEPHOSPHONIC ACID COMPOUNDS | THERMPHOS TRADING GMBH (CH) | 2006-07-20 | — | — | WO | disclosed |