Known targets — ChEMBL curated mechanism
AGTR1DHFRGABBR1GABBR2GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQGARTNR3C2PBP2XPTGS1PTGS2VKORC1blablaT-3blaT-4blaT-5blaT-6dacAdacBdacCfolAftsImrcAmrcBmrdApbp1apbp1bpbp2apbp2bpbp3polthyA
The experimentally established mechanism targets of Bromoacetic 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 | |
|---|---|---|---|---|
| Bromoacetic Acid SCHEMBL7101029 | 0.93 | TSHR (0.50) | — | |
| Bromoacetic Acid SCHEMBL6916707 | 0.92 | CA4 (0.47) | — | |
| Bromoacetic Acid SCHEMBL11405488 | 0.92 | CA4 (0.47) | — | |
| Bromoacetic Acid SCHEMBL6914854 | 0.92 | CA4 (0.47) | — | |
| Bromoacetic Acid SCHEMBL2476064 | 0.92 | — | — | |
| Bromoacetic Acid SCHEMBL789120 | 0.92 | — | — | |
| Bromoacetic Acid SCHEMBL1000560 | 0.92 | — | — | |
| Bromoacetic Acid SCHEMBL6914538 | 0.92 | — | — | |
| Bromoacetic Acid SCHEMBL6916750 | 0.92 | CA4 (0.47) | — | |
| Bromoacetic Acid SCHEMBL6917043 | 0.92 | — | — |
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 122 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-122080384-A | Alkyl benzene ammonium polyether zwitterionic surfactant and preparation method and application thereof | — | 2026-05-26 | — | — | CN | claimed |
| WO-2026044006-A1 | MODIFIED STARCH COMPOUNDS AND USES THEREOF | ISP INVESTMENTS LLC (US) | 2026-02-26 | — | — | WO | claimed |
| US-20250136767-A1 | ULTRASOUND-ASSISTED CARBOXYALKYLATION OF LIGNIN | CORPORATION DE L'ÉCOLE POLYTECHNIQUE DE MONTRÉAL (CA) | 2025-05-01 | — | — | US | claimed |
| CN-119454982-A | Agglutination polypeptide and application thereof | 浙江殷凯生物医药科技有限公司 | 2025-02-18 | — | — | CN | claimed |
| EP-4453307-A1 | ULTRASOUND-ASSISTED CARBOXYALKYLATION OF LIGNIN | Corporation de L'Ecole Polytechnique de Montreal (CA) | 2024-10-30 | — | — | EP | claimed |
| CN-118791496-A | Preparation method of urotropine quaternary ammonium salt | 湖北三峡实验室 | 2024-10-18 | — | — | CN | claimed |
| CN-117964505-A | Synthesis method of N, N-bis (carboxymethyl) -L-lysine | 成都傲科新技术有限责任公司 | 2024-05-03 | — | — | CN | claimed |
| CN-117466799-A | Preparation method of N-substituted phthalimide compound | 西北师范大学 | 2024-01-30 | — | — | CN | claimed |
| CN-116891417-A | Synthesis method of N, N-bis (carboxymethyl) -L-lysine | 成都傲科新技术有限责任公司 | 2023-10-17 | — | — | CN | claimed |
| CN-116764156-A | Fluorine-free composition with fire extinguishing function and method for preparing fluorine-free fire extinguishing agent | 中国石油化工股份有限公司 | 2023-09-19 | — | — | CN | claimed |
| CN-113956262-B | Synthesis method of tetraazacycloalkane compound and intermediate thereof | 苏州百灵威超精细材料有限公司 | 2023-03-07 | — | — | CN | claimed |
| CN-111454460-B | Quartz sand-based ion exchange resin and preparation method thereof | 华中师范大学 | 2022-12-09 | — | — | CN | claimed |
| CN-113880850-B | Gadobutrol intermediate, preparation method and application in gadobutrol preparation | 苏州百灵威超精细材料有限公司 | 2022-10-04 | — | — | CN | claimed |
| CN-113956262-A | Synthesis method of tetraazacycloalkane compound and intermediate thereof | 苏州百灵威超精细材料有限公司 | 2022-01-21 | — | — | CN | claimed |
| CN-113880850-A | Gadobutrol intermediate, preparation method and application in gadobutrol preparation | 苏州百灵威超精细材料有限公司 | 2022-01-04 | — | — | CN | claimed |
| WO-2020202183-A1 | THE PROCESS FOR THE PREPARATION OF UPADACITINIB AND ITS INTERMEDIATES | MYLAN LABORATORIES LIMITED (IN) | 2020-10-08 | — | — | WO | claimed |
| CN-111454460-A | Quartz sand-based ion exchange resin and preparation method thereof | 华中师范大学 | 2020-07-28 | — | — | CN | claimed |
| CN-103910739-B | A kind of Bisbenzylisoquinolincompounds glycine betaine and preparation method thereof and the application in preparing antitumor drug | 山东师范大学 | 2016-08-17 | — | — | CN | claimed |
| US-6057282-A | FORMED BY HEATING IMIDAZOLINE IN PRESENCE OF A BASE AT ELEVATED PH SO AS TO OPEN THE RING, ADDING MONOHALOACETIC SALT, CONTROLLING PH AND TEMPERATURE TO COMPLETE THE REACTION, ISOLATING AND COLLECTING AMPHOACETATE SURFACTANT | RHODIA INC. (US) | 2000-05-02 | — | — | US | claimed |
| US-5210291-A | METHOD FOR PRODUCING DICHLOROPHENYLTHIOGLYCOLIC ACID | SUMITOMO SEIKA CHEMICALS CO., LTD. (JP) | 1993-05-11 | — | — | US | claimed |