⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL12488040 | 0.91 | — | — | |
| SCHEMBL4583774 | 0.80 | ALDH1A1 (0.33) | — | |
| SCHEMBL10787022 | 0.75 | — | — | |
| SCHEMBL620129 | 0.75 | HTT (0.31) | — | |
| SCHEMBL1937416 | 0.72 | — | — | |
| SCHEMBL7696374 | 0.70 | — | — | |
| SCHEMBL21038287 | 0.70 | — | — | |
| SCHEMBL11092806 | 0.68 | — | — | |
| SCHEMBL11095233 | 0.68 | — | — | |
| SCHEMBL3195059 | 0.68 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-5130356-A | Addition of small amounts of diphenoquinone or diphenohydroquinone derivatives; compact disc substrates | BASF AKTIENGESELLSCHAFT (DE) | 1992-07-14 | — | — | US | disclosed |
| EP-0385109-A2 | Shaped article for optical uses | BASF Aktiengesellschaft (DE) | 1990-09-05 | — | — | EP | disclosed |