⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL16862328 | 0.76 | — | — | |
| SCHEMBL14223732 | 0.67 | — | — | |
| SCHEMBL3212042 | 0.67 | — | — | |
| SCHEMBL5747706 | 0.67 | — | — | |
| SCHEMBL908245 | 0.67 | — | — | |
| SCHEMBL14791365 | 0.67 | — | — | |
| SCHEMBL1809246 | 0.67 | — | — | |
| Methane SCHEMBL10339744 | 0.65 | — | — | |
| SCHEMBL13459747 | 0.63 | — | — | |
| SCHEMBL12183460 | 0.62 | — | — |
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 8 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023112021-A1 | CARDIAC STEROID DERIVATIVES | YISSUM RESEARCH DEVELOPMENT COMPANY OF THE HEBREW UNIVERSITY OF JERUSALEM LTD. (IL) | 2023-06-22 | — | — | WO | disclosed |
| US-11130890-B2 | Adhesive composition, adhesive sheet, and method for producing same | TOYO INK SC HOLDINGS CO., LTD. (JP) | 2021-09-28 | — | — | US | disclosed |
| US-20180044562-A1 | ADHESIVE COMPOSITION, ADHESIVE SHEET, AND METHOD FOR PRODUCING SAME | TOYO INK SC HOLDINGS CO., LTD. (JP) | 2018-02-15 | — | — | US | disclosed |
| EP-2740356-A1 | Substituted (2Z)-5(1-Hydroxycyclohexyl)pent-2-en-4-inic acid derivatives | Bayer CropScience AG (DE) | 2014-06-11 | — | — | EP | disclosed |
| EP-2740720-A1 | Substituted bicyclic and tricyclic pent-2-en-4-inic acid derivatives and their use for enhancing the stress tolerance in plants | Bayer CropScience AG (DE) | 2014-06-11 | — | — | EP | disclosed |
| CN-103764642-A | Substituted vinyl-and alkynyl-cyclohexenols as active substances against abiotic stress in plants | BAYER CROPSCIENCE AG | 2014-04-30 | — | — | CN | disclosed |
| US-20140080704-A1 | SUBSTITUTED VINYL AND ALKINYL CYCLOHEXENOLS AS ACTIVE AGENTS AGAINST ABIOTIC STRESS IN PLANTS | BAYER INTELLECTUAL PROPERTY GMBH (DE) | 2014-03-20 | — | — | US | disclosed |
| EP-2511255-A1 | Substituted prop-2-in-1-ol and prop-2-en-1-ol derivatives | Bayer CropScience AG (DE) | 2012-10-17 | — | — | EP | disclosed |