⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL1087317 | 1.00 | — | — | |
| SCHEMBL2295963 | 0.74 | — | — | |
| SCHEMBL7061081 | 0.67 | — | — | |
| SCHEMBL7061084 | 0.67 | — | — | |
| SCHEMBL7031965 | 0.67 | — | — | |
| SCHEMBL5157589 | 0.60 | — | — | |
| SCHEMBL5157583 | 0.60 | — | — | |
| SCHEMBL6165452 | 0.59 | — | — | |
| SCHEMBL3930260 | 0.58 | — | — | |
| SCHEMBL11602107 | 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 7 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-3192794-A1 | SUSTAINED HIV PROTEASE INHIBITOR | Shionogi & Co., Ltd. (JP) | 2017-07-19 | — | — | EP | disclosed |
| US-9688663-B2 | Crosslinking reagents, methods, and compositions for studying protein-protein interactions | Cell Mosaic, Inc. (US) | 2017-06-27 | — | — | US | disclosed |
| US-20160159777-A1 | CROSSLINKING REAGENTS, METHODS, AND COMPOSITIONS FOR STUDYING PROTEIN-PROTEIN INTERACTIONS | CELLMOSAIC INC (US) | 2016-06-09 | — | — | US | disclosed |
| US-20120322978-A1 | CROSSLINKING REAGENTS, METHODS, AND COMPOSITIONS FOR STUDYING PROTEIN-PROTEIN INTERACTIONS | CELLMOSAIC, LLC | 2012-12-20 | — | — | US | disclosed |
| WO-2007079963-A1 | METHOD FOR PRODUCTION AND USE OF NOVEL ORGANOMETAL CATALYSTS HAVING CARBOCYCLIC CARBENES AS STABILIZING AND CONTROL LIGANDS | CATATECH GMBH (DE) | 2007-07-19 | — | — | WO | disclosed |
| EP-1747883-A2 | Infrared-sensitive planographic printing plate precursor | Fuji Photo Film Co., Ltd. (JP) | 2007-01-31 | — | — | EP | disclosed |
| EP-0011669-A1 | Cycloheptatriene compounds and process for the preparation of cycloheptatriene compounds | BAYER AG (DE) | 1980-06-11 | — | — | EP | disclosed |