⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL4947490 | 0.86 | MAPK1 (0.31) | — | |
| SCHEMBL4945284 | 0.81 | MAPK1 (0.36) | — | |
| SCHEMBL4947285 | 0.80 | SPHK1 (0.30) | — | |
| SCHEMBL11432693 | 0.79 | FDPS (0.32) | — | |
| SCHEMBL11514263 | 0.75 | TSHR (0.39) | — | |
| SCHEMBL4940464 | 0.74 | FDPS (0.33) | — | |
| SCHEMBL21359695 | 0.74 | TSHR (0.32) | — | |
| SCHEMBL4945764 | 0.73 | MMP8 (0.32) | — | |
| SCHEMBL7595313 | 0.71 | — | — | |
| SCHEMBL7606375 | 0.71 | USP2 (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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1939165-B1 | POLYVINYL ETHER COMPOUND | IDEMITSU KOSAN CO (JP) | 2012-06-13 | — | — | EP | disclosed |
| US-20080108850-A1 | Addition-condensation copolymers containing polyoxyethylene glycol; high viscosity; used as lubricating oil for compression refrigerator | IDEMITSU KOSAN CO., LTD. (JP) | 2008-05-08 | — | — | US | disclosed |