⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17448131 | 1.00 | — | — | |
| Water SCHEMBL5684260 | 0.86 | TRPA1 (0.30) | — | |
| SCHEMBL28620740 | 0.81 | — | — | |
| SCHEMBL28621213 | 0.81 | — | — | |
| SCHEMBL28623053 | 0.81 | — | — | |
| SCHEMBL845988 | 0.81 | — | — | |
| SCHEMBL16596134 | 0.78 | — | — | |
| SCHEMBL892176 | 0.78 | — | — | |
| SCHEMBL845432 | 0.78 | LPAR2 (0.33) | — | |
| SCHEMBL18860351 | 0.78 | — | — |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2371912-B1 | Active radiation curable ink composition, ink composition for inkjet recording, printed matter, and method of producing molded article of printed matter | FUJIFILM CORP (JP) | 2014-04-30 | — | — | EP | disclosed |
| US-8573765-B2 | Active radiation curable ink composition, ink composition for inkjet recording, printed matter, and method of producing molded article of printed matter | FUJIFILM CORPORATION (JP) | 2013-11-05 | — | — | US | disclosed |
| US-20110241264-A1 | ACTIVE RADIATION CURABLE INK COMPOSITION, INK COMPOSITION FOR INKJET RECORDING, PRINTED MATTER, AND METHOD OF PRODUCING MOLDED ARTICLE OF PRINTED MATTER | FUJIFILM CORPORATION (JP) | 2011-10-06 | — | — | US | disclosed |
| EP-2371912-A1 | Active radiation curable ink composition, ink composition for inkjet recording, printed matter, and method of producing molded article of printed matter | Fujifilm Corporation (JP) | 2011-10-05 | — | — | EP | disclosed |