⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL21045005 | 0.76 | GABRA1 (0.39) | — | |
| SCHEMBL2161704 | 0.75 | XDH (0.44) | — | |
| SCHEMBL5670666 | 0.73 | XDH (0.38) | — | |
| SCHEMBL8415124 | 0.73 | XDH (0.31) | — | |
| SCHEMBL8415107 | 0.73 | XDH (0.31) | — | |
| SCHEMBL3263937 | 0.73 | TP53 (0.32) | — | |
| SCHEMBL9808624 | 0.73 | PTGDR (0.34) | — | |
| SCHEMBL9545554 | 0.73 | CHRNB2 (0.31) | — | |
| SCHEMBL8521841 | 0.69 | PTGS2 (0.35) | — | |
| SCHEMBL8545069 | 0.69 | ALDH1A1 (0.47) | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4451556-A | Tellurium imaging composition including base | ENERGY CONVERSION DEVICES, INC. (US) | 1984-05-29 | — | — | US | claimed |
| EP-0098018-A2 | Imaging film and composition employing an organo-metallic compound and method for recording electromagnetic radiation | ENERGY CONVERSION DEVICES, INC. (US) | 1984-01-11 | — | — | EP | claimed |
| US-4340662-A | PHOTOSENSITIVE FILMS | ENERGY CONVERSION DEVICES, INC. (US) | 1982-07-20 | — | — | US | disclosed |