⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL2481830 | 0.98 | — | — | |
| Acrylonitrile SCHEMBL3234114 | 0.89 | — | — | |
| SCHEMBL3233493 | 0.85 | — | — | |
| SCHEMBL9466180 | 0.80 | — | — | |
| SCHEMBL15516294 | 0.80 | — | — | |
| SCHEMBL27751738 | 0.78 | MEN1 (0.36) | — | |
| SCHEMBL29200127 | 0.74 | — | — | |
| SCHEMBL3230946 | 0.74 | TSHR (0.31) | — | |
| SCHEMBL4112103 | 0.73 | — | — | |
| SCHEMBL4964932 | 0.73 | — | — |
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-5242781-A | Exposure and development of light sensitive silver halide emulsions with dye donor compounds by superimposing dye image receivers with polyvinyl chloride or polyester binders | KONICA CORPORATION (JP) | 1993-09-07 | — | — | US | disclosed |
| US-4500693-A | OF (METH-)ACRYLIC ACID (OR SALT THEREOF) AND ALLYL ETHERSULFONATE | NIPPON SHOKUBAI KAGAKU KOGYO CO., LTD. (JP) | 1985-02-19 | — | — | US | disclosed |