⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL23314768 | 0.84 | ALDH1A1 (0.30) | — | |
| SCHEMBL14619804 | 0.81 | — | — | |
| SCHEMBL14619558 | 0.79 | TSHR (0.30) | — | |
| SCHEMBL14619499 | 0.79 | — | — | |
| SCHEMBL18194366 | 0.71 | — | — | |
| SCHEMBL10308723 | 0.69 | TSHR (0.32) | — | |
| SCHEMBL18642897 | 0.69 | — | — | |
| SCHEMBL18327283 | 0.69 | — | — | |
| SCHEMBL13482981 | 0.67 | MAPK1 (0.41) | — | |
| SCHEMBL3935974 | 0.65 | — | — |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7172855-B2 | Silver halide photographic light-sensitive material and package thereof | FUJI PHOTO FILM CO., LTD. (JP) | 2007-02-06 | — | — | US | disclosed |