⚠ 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 | |
|---|---|---|---|---|
| SCHEMBL7465109 | 0.79 | TRPA1 (0.30) | — | |
| SCHEMBL7465107 | 0.79 | TRPA1 (0.30) | — | |
| SCHEMBL12840925 | 0.76 | — | — | |
| SCHEMBL6973127 | 0.73 | — | — | |
| SCHEMBL14491143 | 0.73 | — | — | |
| SCHEMBL12990363 | 0.71 | — | — | |
| SCHEMBL9830085 | 0.71 | — | — | |
| SCHEMBL27413585 | 0.71 | TYR (0.30) | — | |
| SCHEMBL15212591 | 0.71 | — | — | |
| SCHEMBL22856694 | 0.70 | — | — |
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 18 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-112410799-B | Method for producing hydrogen | 湖南大学 | 2022-03-29 | — | — | CN | claimed |
| CN-112410799-A | Method for producing hydrogen | 湖南大学 | 2021-02-26 | — | — | CN | claimed |
| US-12485113-B2 | Pharmaceutical use of (e)-3-arylheterocyclylprop-2-enoic acid derivatives | MEDCURIUS INC. (CN) | 2025-12-02 | — | — | US | disclosed |
| US-20230285372-A1 | Pharmaceutical use of (E)-3-arylheterocyclylprop-2-enoic acid derivatives | MEDCURIUS INC. (CN) | 2023-09-14 | — | — | US | disclosed |
| US-20230285372-A1 | Pharmaceutical use of (E)-3-arylheterocyclylprop-2-enoic acid derivatives | MEDCURIUS INC. (CN) | 2023-09-14 | — | — | US | disclosed |
| US-20230285372-A1 | Pharmaceutical use of (E)-3-arylheterocyclylprop-2-enoic acid derivatives | MEDCURIUS INC. (CN) | 2023-09-14 | — | — | US | disclosed |
| CN-111556871-B | 1H-pyrazolo [4,3-b ] pyridines as PDE1 inhibitors | H.隆德贝克有限公司 | 2023-07-07 | — | — | CN | disclosed |
| US-20220106327-A1 | INHIBITORS OF APOL1 AND METHODS OF USING SAME | VERTEX PHARMACEUTICALS INCORPORATED (US) | 2022-04-07 | — | — | US | disclosed |
| CN-112410799-B | Method for producing hydrogen | 湖南大学 | 2022-03-29 | — | — | CN | disclosed |
| WO-2021259143-A1 | PHARMACEUTICAL USE OF (E)-3-ARYLHETEROCYCLYL PROP-2-ENOIC ACID DERIVATIVES | 上海长车生物科技有限公司 | 2021-12-30 | — | — | WO | disclosed |
| CN-112410799-A | Method for producing hydrogen | 湖南大学 | 2021-02-26 | — | — | CN | disclosed |
| US-10646494-B2 | Heterocycle-substituted tetracyclic compounds and methods of use thereof for the treatment of viral diseases | MERCK SHARP & DOHME CORP. (US) | 2020-05-12 | — | — | US | disclosed |
| CN-109311872-A | 1H- pyrazolo [4,3-b] pyridine as PDE1 inhibitor | H.隆德贝克有限公司 | 2019-02-05 | — | — | CN | disclosed |
| WO-2018032468-A1 | HETEROCYCLE-SUBSTITUED TETRACYCLIC COMPOUNDS AND METHODS OF USE THEREOF FOR TREATMENT OF VIRAL DISEASES | MERCK SHARP & DOHME CORP. (US) | 2018-02-22 | — | — | WO | disclosed |
| EP-0771796-B1 | Substituted S-triazines and process for their preparation | AGFA GEVAERT (BE) | 2002-06-19 | — | — | EP | disclosed |
| CN-1051546-C | Novel 1,1-bis (heteroazolyl) alkane derivatives and their use as neuroprotective agents | ASTRA AB (SE) | 2000-04-19 | — | — | CN | disclosed |
| CN-1150426-A | Novel 1,1-bis (heteroazolyl) alkane derivatives and their use as neuroprotective agents | ASTRA AB (SE) | 1997-05-21 | — | — | CN | disclosed |
| EP-0771796-A1 | Substituted S-triazines and process for their preparation | HOECHST AKTIENGESELLSCHAFT (DE) | 1997-05-07 | — | — | EP | disclosed |