⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL22115917 | 0.87 | TSHR (0.38) | — | |
| SCHEMBL28860041 | 0.71 | TSHR (0.32) | — | |
| SCHEMBL3094871 | 0.69 | FDPS (0.34) | — | |
| SCHEMBL19878887 | 0.69 | — | — | |
| Hexane SCHEMBL28052969 | 0.67 | TSHR (0.47) | — | |
| SCHEMBL28290739 | 0.65 | OPRM1 (0.48) | — | |
| SCHEMBL22401674 | 0.62 | TSHR (0.47) | — | |
| Bromide SCHEMBL19637946 | 0.62 | — | — | |
| SCHEMBL2487739 | 0.60 | — | — | |
| SCHEMBL22027595 | 0.60 | TSHR (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-0229014-B1 | MAGNETIC RECORDING MEDIUM | SONY CORPORATION (JP) | 1993-03-24 | — | — | EP | disclosed |
| US-4735848-A | PERFLUOROALKYL ESTER LUBRICANT | SONY CORPORATION (JP) | 1988-04-05 | — | — | US | disclosed |
| EP-0229014-A2 | Magnetic recording medium | SONY CORPORATION (JP) | 1987-07-15 | — | — | EP | disclosed |