⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL483302 | 0.79 | — | — | |
| SCHEMBL614942 | 0.78 | — | — | |
| SCHEMBL613453 | 0.75 | PTGS2 (0.31) | — | |
| SCHEMBL1551979 | 0.74 | — | — | |
| SCHEMBL483063 | 0.74 | — | — | |
| SCHEMBL8127639 | 0.71 | KCNH2 (0.41) | — | |
| SCHEMBL1235190 | 0.70 | — | — | |
| SCHEMBL1480704 | 0.70 | — | — | |
| SCHEMBL8114611 | 0.70 | KCNH2 (0.44) | — | |
| SCHEMBL8113700 | 0.70 | KCNH2 (0.44) | — |
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-2779830-B1 | STABILIZATION OF COMPOUNDS CONTAINING IODINE HAVING POLYMERS COMPRISING NITROGEN | LANXESS DEUTSCHLAND GMBH (DE) | 2017-05-17 | — | — | EP | claimed |
| EP-2831161-B1 | FUNGICIDE FORMULATIONS FOR PLASTICIZED PVC | LANXESS DEUTSCHLAND GMBH (DE) | 2015-11-18 | — | — | EP | claimed |
| EP-1382248-B1 | Stabilized haloalkynyl microbicide compositions | ROHM & HAAS (US) | 2005-10-05 | — | — | EP | claimed |