⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL505184 | 0.97 | — | — | |
| SCHEMBL822771 | 0.97 | — | — | |
| SCHEMBL1130024 | 0.97 | — | — | |
| SCHEMBL3053013 | 0.87 | GABRR1 (0.41) | — | |
| SCHEMBL108300 | 0.78 | TSHR (0.41) | — | |
| SCHEMBL7753987 | 0.77 | — | — | |
| Cyclopropane Carboxylic Acid SCHEMBL11660538 | 0.76 | PLG (0.39) | — | |
| SCHEMBL12028769 | 0.75 | FOLH1 (0.32) | — | |
| SCHEMBL23767390 | 0.74 | — | — | |
| SCHEMBL290488 | 0.74 | — | — |
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 10 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117603028-A | Preparation method of 3, 7-diethyl-3, 7-dimethyl nonane-4, 6-dione | 中钢天源股份有限公司 | 2024-02-27 | — | — | CN | disclosed |
| CN-110922429-A | Organic luminescent material containing novel auxiliary ligand | 北京夏禾科技有限公司 | 2020-03-27 | — | — | CN | disclosed |
| US-5086184-A | Herbicides | DOWELANCO (US) | 1992-02-04 | — | — | US | disclosed |
| US-4943634-A | HERBICIDES | ELI LILLY AND COMPANY (US) | 1990-07-24 | — | — | US | disclosed |
| US-4801718-A | HERBICIDES | ELI LILLY AND COMPANY (US) | 1989-01-31 | — | — | US | disclosed |
| US-4636243-A | HERBICIDES ISOXAZOLES | ELI LILLY AND COMPANY (US) | 1987-01-13 | — | — | US | disclosed |
| US-4515625-A | HERBICIDES | ELI LILLY AND COMPANY (US) | 1985-05-07 | — | — | US | disclosed |
| EP-0049071-B1 | N-ARYLBENZAMIDE DERIVATIVES | ELI LILLY AND COMPANY (US) | 1984-12-19 | — | — | EP | disclosed |
| US-4416683-A | HERBICIDES | ELI LILLY AND COMPANY (US) | 1983-11-22 | — | — | US | disclosed |
| EP-0049071-A1 | N-arylbenzamide derivatives | ELI LILLY AND COMPANY (US) | 1982-04-07 | — | — | EP | disclosed |