⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL17506703 | 0.77 | — | — | |
| SCHEMBL28527137 | 0.76 | SLC6A12 (0.32) | — | |
| SCHEMBL20876404 | 0.75 | — | — | |
| SCHEMBL4788629 | 0.75 | — | — | |
| SCHEMBL23685957 | 0.75 | HTR2A (0.32) | — | |
| SCHEMBL862190 | 0.73 | EPHX2 (0.31) | — | |
| SCHEMBL8232297 | 0.73 | GABRR1 (0.33) | — | |
| SCHEMBL22191725 | 0.72 | — | — | |
| SCHEMBL14279956 | 0.72 | — | — | |
| SCHEMBL9322177 | 0.67 | — | — |
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-2023069884-A1 | KDM1A INHIBITORS FOR THE TREATMENT OF DISEASE | IMAGO BIOSCIENCES, INC. (US) | 2023-04-27 | — | — | WO | disclosed |
| EP-3634968-B1 | HETEROCYCLIC COMPOUNDS USEFUL AS ANTI-BACTERIAL AGENTS AND METHOD FOR PRODUCTION THEREOF | BUGWORKS RES INC (US) | 2023-01-25 | — | — | EP | disclosed |
| US-20200283439-A1 | TRICYCLIC QUINOLINE AND QUINOXALINE DERIVATIVES | AbbVie Deutschland GmbH & Co. KG (DE) | 2020-09-10 | — | — | US | disclosed |
| WO-2020047518-A1 | IRE1 KINASE INHIBITORS AND USES THEREOF | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2020-03-05 | — | — | WO | disclosed |
| US-20190211498-A1 | Silk Performance Apparel and Products and Methods of Preparing the Same | EVOLVED BY NATURE, INC. | 2019-07-11 | — | — | US | disclosed |