⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL10599005 | 1.00 | — | — | |
| SCHEMBL24491144 | 1.00 | — | — | |
| SCHEMBL10598999 | 1.00 | — | — | |
| SCHEMBL28236378 | 0.97 | TSHR (0.39) | — | |
| SCHEMBL15713527 | 0.93 | TSHR (0.50) | — | |
| SCHEMBL23575220 | 0.93 | TSHR (0.50) | — | |
| SCHEMBL9815760 | 0.90 | TSHR (0.47) | — | |
| SCHEMBL23916930 | 0.90 | TSHR (0.47) | — | |
| SCHEMBL4404822 | 0.90 | — | — | |
| SCHEMBL22417709 | 0.88 | TSHR (0.40) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025111414-A1 | TRPM3-MODULATING BENZOFURAN DERIVATIVES | KATHOLIEKE UNIVERSITEIT LEUVEN (BE) | 2025-05-30 | — | — | WO | disclosed |
| US-20240150324-A1 | 5-Membered Heteroaryl Carboxamide Compounds for Treatment of HBV | ASSEMBLY BIOSCIENCES, INC. | 2024-05-09 | — | — | US | disclosed |
| US-11560370-B1 | 5-membered heteroaryl carboxamide compounds for treatment of HBV | ASSEMBLY BIOSCIENCES, INC. (US) | 2023-01-24 | — | — | US | disclosed |
| WO-2022117075-A1 | AZACYCLIC COMPOUND, AND PREPARATION METHOD THEREFOR AND USE THEREOF | 广州费米子科技有限责任公司 | 2022-06-09 | — | — | WO | disclosed |
| CN-108341830-A | Thienopyrimidine derivative and its application in drug | 广东东阳光药业有限公司 | 2018-07-31 | — | — | CN | disclosed |
| WO-2018133858-A1 | THIENOPYRIMIDINE DERIVATIVE AND USE THEREOF IN MEDICINE | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2018-07-26 | — | — | WO | disclosed |
| CN-104926706-B | Salt of hexahydro pentalene derivative and its preparation method and application | 广东东阳光药业有限公司 | 2017-12-05 | — | — | CN | disclosed |
| WO-2015139638-A1 | SALTS OF HEXAHYDROPENTALENO DERIVATIVES, PREPARATION METHODAND USE IN MEDICINE THEREOF | SUNSHINE LAKE PHARMA CO., LTD. (CN) | 2015-09-24 | — | — | WO | disclosed |
| US-7071359-B1 | Neuropathy improvers containing nitrogenous compounds as the active ingredient | TEIJIN LIMITED (JP) | 2006-07-04 | — | — | US | disclosed |
| EP-0105651-A1 | Bicyclo(3.3.0)octane derivatives | ONO PHARMACEUTICAL CO., LTD. (JP) | 1984-04-18 | — | — | EP | disclosed |