Known targets — ChEMBL curated mechanism
ACHEBDKRB2CHRM1CHRM2CHRM3CHRNA1CHRNB1CHRNDCHRNECHRNGGUCY1A1GUCY1A2GUCY1B1GUCY1B2NAMPTPTAFRSLC10A2SLC6A2SLC6A3TACR1dacAdacBdacCftsImrcAmrcBmrdA
The experimentally established mechanism targets of Hydrochloric Acid. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.
⚠ 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 | |
|---|---|---|---|---|
| Water SCHEMBL6586963 | 0.89 | — | — | |
| Water SCHEMBL3509082 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL295562 | 0.87 | — | — | |
| SCHEMBL28224816 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL2294091 | 0.87 | — | — | |
| Hydrochloric Acid SCHEMBL7168696 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL2283898 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL6213692 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL3277379 | 0.75 | — | — | |
| Hydrochloric Acid SCHEMBL6620970 | 0.75 | — | — |
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 129 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117447360-A | Preparation method of multi-chiral central diamine derivative | 南京桦冠生物技术有限公司 | 2024-01-26 | — | — | CN | claimed |
| CN-111196778-B | Synthetic method of 3-ethylamino pyrrole compound | 郑州轻工业大学 | 2022-08-19 | — | — | CN | claimed |
| CN-111196778-A | Synthetic method of 3-ethylamino pyrrole compound | 郑州轻工业大学 | 2020-05-26 | — | — | CN | claimed |
| EP-0430847-A1 | Procedure for the preparation of N-cyclopropyl-4-fluoroanilines | CENTRO MARGA PARA LA INVESTIGACION S.A. (ES) | 1991-06-05 | — | — | EP | claimed |
| WO-2024053650-A1 | COMPOUND HAVING INHIBITORY ACTIVITY AGAINST DIACYLGLYCEROL KINASE α AND/OR ζ, AND PHARMACEUTICAL USE THEREOF | 小野薬品工業株式会社 | 2024-03-14 | — | — | WO | disclosed |
| US-20240083899-A1 | PURINONE DERIVATIVE | ONO PHARMACEUTICAL CO., LTD. (JP) | 2024-03-14 | — | — | US | disclosed |
| CN-117447360-A | Preparation method of multi-chiral central diamine derivative | 南京桦冠生物技术有限公司 | 2024-01-26 | — | — | CN | disclosed |
| EP-3632898-B1 | EP4 ANTAGONIST | ONO PHARMACEUTICAL CO (JP) | 2023-07-12 | — | — | EP | disclosed |
| EP-3590938-B1 | PURINONE DERIVATIVE AS BTK KINASE INHIBITOR | ONO PHARMACEUTICAL CO (JP) | 2023-05-24 | — | — | EP | disclosed |
| US-20220388955-A1 | EP2 ANTAGONIST | ONO PHARMACEUTICAL CO., LTD. (JP) | 2022-12-08 | — | — | US | disclosed |
| US-11479550-B2 | EP4 antagonist | ONO PHARMACEUTICAL CO., LTD. (JP) | 2022-10-25 | — | — | US | disclosed |
| CN-111196778-B | Synthetic method of 3-ethylamino pyrrole compound | 郑州轻工业大学 | 2022-08-19 | — | — | CN | disclosed |
| US-5354766-A | 2-Ethoxy-1-((2'(2,5-dihydro-5-oxo-1,2,4-oxadiazol-3-yl) biphenyl-4-yl)methyl)benzimidazole-7-carboxylic acid; hypotensive agents; CNS activity | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1994-10-11 | — | — | US | disclosed |
| US-5243054-A | Hypotensive agents, cardiovascular disorders or nervous system disorders | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1993-09-07 | — | — | US | disclosed |
| EP-0520423-A2 | Heterocyclic compounds, their production and use as angiotensin II antagonists | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1992-12-30 | — | — | EP | disclosed |
| EP-0156456-B1 | [(1,3,-dioxo-1,3-propanediyl)diimino] bisbenzoic acid derivatives and their use | SAWAI PHARMACEUTICAL CO., LTD. (JP) | 1989-11-15 | — | — | EP | disclosed |
| US-4822791-A | ANTIALLERGENS | SAWAI PHARMACEUTICAL CO., LTD. (JP) | 1989-04-18 | — | — | US | disclosed |
| US-4755506-A | Pharmaceutical compositions of [(1,3,-dioxo-1,3-propanediyl)diimino]bisbenzoic acid derivatives and their use | SAWAI PHARMACEUTICAL CO., LTD. (JP) | 1988-07-05 | — | — | US | disclosed |
| US-4634777-A | HYALURONIDASE INHIBITORS | SAWAI PHARMACEUTICAL CO., LTD. (JP) | 1987-01-06 | — | — | US | disclosed |
| EP-0156456-A1 | [(1,3,-dioxo-1,3-propanediyl)diimino] bisbenzoic acid derivatives and their use | SAWAI PHARMACEUTICAL CO., LTD. (JP) | 1985-10-02 | — | — | EP | disclosed |