⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL19215716 | 0.84 | TSHR (0.38) | — | |
| SCHEMBL4942699 | 0.84 | TSHR (0.38) | — | |
| SCHEMBL4939567 | 0.78 | SPHK1 (0.42) | — | |
| SCHEMBL7059800 | 0.78 | — | — | |
| SCHEMBL27489045 | 0.77 | TSHR (0.41) | — | |
| SCHEMBL4945280 | 0.77 | TSHR (0.38) | — | |
| Propylene Glycol SCHEMBL4452363 | 0.77 | TDP1 (0.56) | — | |
| SCHEMBL3270345 | 0.77 | FPR2 (0.33) | — | |
| SCHEMBL5708615 | 0.77 | FPR2 (0.33) | — | |
| SCHEMBL4164545 | 0.77 | SPHK1 (0.45) | — |
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-1939165-B1 | POLYVINYL ETHER COMPOUND | IDEMITSU KOSAN CO (JP) | 2012-06-13 | — | — | EP | disclosed |
| EP-1939165-A1 | POLYVINYL ETHER COMPOUND | IDEMITSU KOSAN CO., LTD. (JP) | 2008-07-02 | — | — | 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 |