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 | |
|---|---|---|---|---|
| SCHEMBL2902826 | 0.97 | — | — | |
| Iodide SCHEMBL7629995 | 0.93 | — | — | |
| SCHEMBL3113482 | 0.85 | ALDH1A1 (0.32) | — | |
| Thiocyanic Acid SCHEMBL5096236 | 0.81 | — | — | |
| SCHEMBL5099958 | 0.79 | — | — | |
| SCHEMBL17514043 | 0.79 | ALDH1A1 (0.33) | — | |
| Trifluoromethanesulfonic Acid SCHEMBL5102952 | 0.72 | — | — | |
| Hydrochloric Acid SCHEMBL9344372 | 0.67 | ALDH1A1 (0.32) | — | |
| Hydrochloric Acid SCHEMBL277965 | 0.65 | — | — | |
| Hydrochloric Acid SCHEMBL1184026 | 0.65 | — | — |
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 100 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0439745-B1 | Process for the preparation of 2-chloro-5-methyl-pyridine | BAYER AG (DE) | 1994-08-03 | — | — | EP | claimed |
| US-5103011-A | PREPARATION OF 2-CHLORO-5- METHYL-PYRIDINE | BAYER AKTIENGESELLSCHAFT (DE) | 1992-04-07 | — | — | US | claimed |
| EP-0439745-A2 | Process for the preparation of 2-chloro-5-methyl-pyridine | BAYER AG (DE) | 1991-08-07 | — | — | EP | claimed |
| US-20230131316-A1 | PROCESSES AND INTERMEDIATES FOR THE PREPARATIONS OF CARBOPROST AND CARBOPROST TROMETHAMINE, AND CARBOPROST TROMETHAMINE PREPARED THEREFROM | CHIROGATE INTERNATIONAL INC. (TW) | 2023-04-27 | — | — | US | disclosed |
| EP-4140982-A2 | PROCESSES AND INTERMEDIATES FOR THE PREPARATIONS OF CARBOPROST AND CARBOPROST TROMETHAMINE, AND CARBOPROST TROMETHAMINE PREPARED THEREFROM | Chirogate International Inc. (TW) | 2023-03-01 | — | — | EP | disclosed |
| US-10822321-B2 | Processes and intermediates for the preparations of isomer free prostaglandins | CHIROGATE INTERNATIONAL INC. (TW) | 2020-11-03 | — | — | US | disclosed |
| US-10403824-B2 | Electronic device and compound | NOVALED GMBH (DE) | 2019-09-03 | — | — | US | disclosed |
| US-10385004-B2 | Process and intermediates for the preparation of NEP inhibitors | NOVARTIS AG (CH) | 2019-08-20 | — | — | US | disclosed |
| EP-3256444-B1 | PROCESS AND INTERMEDIATES FOR THE PREPARATION OF NEP INHIBITORS | NOVARTIS AG (CH) | 2019-03-27 | — | — | EP | disclosed |
| US-20180251442-A1 | PROCESSES AND INTERMEDIATES FOR THE PREPARATIONS OF ISOMER FREE PROSTAGLANDINS | CHIROGATE INTERNATIONAL INC. (TW) | 2018-09-06 | — | — | US | disclosed |
| US-9994543-B2 | Processes and intermediates for the preparations of isomer free prostaglandins | CHIROGATE INTERNATIONAL INC. (TW) | 2018-06-12 | — | — | US | disclosed |
| US-3974140-A | BACTERICIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-08-10 | — | — | US | disclosed |
| US-3974142-A | BACTERICIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-08-10 | — | — | US | disclosed |
| US-3972869-A | Penicillins | BAYER AKTIENGESELLSCHAFT (DT) | 1976-08-03 | — | — | US | disclosed |
| US-3972870-A | IMIDAZOLIDINYL-CARBAMIDO-BACTERICIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-08-03 | — | — | US | disclosed |
| US-3959258-A | BACTERICIDES | BAYER AKTIENGESELLSCHAFT (DT) | 1976-05-25 | — | — | US | disclosed |
| US-3953428-A | ANTIBACTERIAL | YAMANOUCHI PHARMACEUTICAL CO., LTD. (JA) | 1976-04-27 | — | — | US | disclosed |
| US-3939149-A | BACTERICIDE | BAYER AKTIENGESELLSCHAFT (DT) | 1976-02-17 | — | — | US | disclosed |
| US-3936442-A | ANTIBIOTIC | BAYER AKTIENGESELLSCHAFT (DT) | 1976-02-03 | — | — | US | disclosed |
| US-3933795-A | Ureidoacetamido-penicillins | Konig, Hans-Bodo (DT) | 1976-01-20 | — | — | US | disclosed |