⚠ 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 | |
|---|---|---|---|---|
| Oxazole SCHEMBL27506407 | 0.84 | — | — | |
| SCHEMBL57549 | 0.76 | — | — | |
| Benzoquinone SCHEMBL28350037 | 0.74 | ALDH1A1 (0.40) | — | |
| Lithium SCHEMBL17474380 | 0.73 | — | — | |
| Methane SCHEMBL222390 | 0.73 | — | — | |
| Methane SCHEMBL190374 | 0.73 | — | — | |
| Ammonia Solution, Strong SCHEMBL3496230 | 0.73 | — | — | |
| Hydrochloric Acid SCHEMBL1554036 | 0.73 | — | — | |
| Pyrimidine SCHEMBL6803514 | 0.71 | — | — | |
| Oxazole SCHEMBL29728171 | 0.71 | — | — |
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-5279919-A | Containing a hydrazide compound | FUJI PHOTO FILM CO., LTD. (JP) | 1994-01-18 | — | — | US | disclosed |