⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3120942 | 0.98 | TSHR (0.30) | — | |
| Selenium SCHEMBL9841074 | 0.96 | — | — | |
| SCHEMBL8073270 | 0.96 | — | — | |
| SCHEMBL29170924 | 0.87 | — | — | |
| SCHEMBL7646391 | 0.72 | — | — | |
| SCHEMBL1078861 | 0.70 | — | — | |
| SCHEMBL28902213 | 0.70 | TSHR (0.31) | — | |
| SCHEMBL17477099 | 0.70 | — | — | |
| SCHEMBL28515565 | 0.69 | TSHR (0.35) | — | |
| SCHEMBL28515563 | 0.69 | TSHR (0.35) | — |
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 |
|---|---|---|---|---|---|---|---|
| JP-3082593-A | — | — | None | — | — | JP | disclosed |
| US-5024927-A | For reversible recording by applying electromagnetic waves of different powers and wavelengths | RICOH COMPANY, LTD. (JP) | 1991-06-18 | — | — | US | disclosed |
| JP-H0382593-A | DATA RECORDING MEDIUM | RICOH CO LTD | 1991-04-08 | — | — | JP | disclosed |