⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL3994069 | 1.00 | — | — | |
| SCHEMBL21883699 | 1.00 | — | — | |
| SCHEMBL4310329 | 1.00 | — | — | |
| SCHEMBL7357222 | 1.00 | — | — | |
| SCHEMBL18937993 | 1.00 | — | — | |
| SCHEMBL3293309 | 1.00 | — | — | |
| SCHEMBL18937990 | 1.00 | — | — | |
| SCHEMBL21883846 | 1.00 | — | — | |
| SCHEMBL10282829 | 0.84 | CA1 (0.40) | — | |
| SCHEMBL21883847 | 0.79 | SAE1 (0.31) | — |
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 5 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2023082574-A1 | METHOD FOR SYNTHESIZING SELAMECTIN | 浙江荣耀生物科技股份有限公司 | 2023-05-19 | — | — | WO | disclosed |
| WO-2021242849-A1 | ANTIBACTERIAL COMPOUNDS, COMPOSITIONS THEREOF, AND METHODS USING SAME | THE ROCKEFELLER UNIVERSITY (US) | 2021-12-02 | — | — | WO | disclosed |
| WO-2018075996-A1 | SIMVASTATIN AND CHEMOTHERAPEUTIC CONJUGATES WITH A HEPTAMETHINE CARBOCYANINE DYE RESENSITIZE HUMAN TUMORS TO HORMONAL ANTAGONISTS AND CHEMOTHERAPY | CEDARS-SINAI MEDICAL CENTER (US) | 2018-04-26 | — | — | WO | disclosed |
| WO-2018075994-A1 | COMPOUNDS AND METHODS TO SENSITIZE CANCER CELLS TO CISPLATIN | DA ZEN THERANOSTICS, INC (US) | 2018-04-26 | — | — | WO | disclosed |
| US-20140315842-A1 | Avermectins and Milbemycins as Anti-Mycobacterial Agents | THOMPSON, CHARLES J. (CA) | 2014-10-23 | — | — | US | disclosed |