⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL26020712 | 0.81 | — | — | |
| SCHEMBL9887537 | 0.81 | — | — | |
| SCHEMBL28910859 | 0.80 | TRPA1 (0.36) | — | |
| SCHEMBL18885808 | 0.80 | TRPA1 (0.36) | — | |
| SCHEMBL32689466 | 0.78 | PPARA (0.39) | — | |
| SCHEMBL10892837 | 0.77 | — | — | |
| SCHEMBL27984620 | 0.77 | — | — | |
| SCHEMBL9006790 | 0.77 | — | — | |
| SCHEMBL23560963 | 0.76 | TRPA1 (0.35) | — | |
| SCHEMBL16265027 | 0.75 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023189861-A1 | COMPOSITION, ORGANIC ELECTROLUMINESCENT ELEMENT, METHOD FOR PRODUCING SAME, DISPLAY DEVICE, AND LIGHTING DEVICE | 三菱ケミカル株式会社 | 2023-10-05 | — | — | WO | disclosed |
| EP-3764416-A1 | COMPOUND FOR ORGANIC ELECTRONIC ELEMENT, ORGANIC ELECTRONIC ELEMENT USING THE SAME, AND AN ELECTRONIC DEVICE THEREOF | Duk San Neolux Co., Ltd. (KR) | 2021-01-13 | — | — | EP | disclosed |
| EP-3424936-A1 | METAL COMPLEXES | Merck Patent GmbH (DE) | 2019-01-09 | — | — | EP | disclosed |
| WO-2009089042-A1 | PYRAZOLE PYRAZINE AMINE COMPOUNDS AS KINASE INHIBITORS, COMPOSITIONS THEREOF AND METHODS OF TREATMENT THEREWITH | SIGNAL PHARMACEUTICALS, LLC (US) | 2009-07-16 | — | — | WO | disclosed |