⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL14544330 | 0.94 | ALDH1A1 (0.35) | — | |
| SCHEMBL28902420 | 0.90 | ALDH1A1 (0.33) | — | |
| SCHEMBL28572154 | 0.90 | NR1I2 (0.33) | — | |
| SCHEMBL4941271 | 0.88 | LMNA (0.35) | — | |
| SCHEMBL538872 | 0.87 | — | — | |
| SCHEMBL7712053 | 0.83 | NR1I2 (0.37) | — | |
| SCHEMBL3910942 | 0.83 | NR1I2 (0.37) | — | |
| SCHEMBL3391572 | 0.83 | NR1I2 (0.37) | — | |
| SCHEMBL8991826 | 0.82 | NR1I2 (0.41) | — | |
| SCHEMBL20250046 | 0.81 | — | — |
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-5488128-A | Monomer for high refractive index plastics | ROEHM GMBH CHEMISCHE FABRIK (DE) | 1996-01-30 | — | — | US | disclosed |
| EP-0219033-B1 | SILVER HALIDE COLOR PHOTOGRAPHIC LIGHT-SENSITIVE MATERIAL CONTAINING A HYDROQUINONE DERIVATIVE | FUJI PHOTO FILM CO., LTD. (JP) | 1992-04-29 | — | — | EP | disclosed |