Known targets — ChEMBL curated mechanism
GABRA1GABRA2GABRA3GABRA4GABRA5GABRA6GABRB1GABRB2GABRB3GABRDGABREGABRG1GABRG2GABRG3GABRPGABRQ
The experimentally established mechanism targets of Water. 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 SCHEMBL27770753 | 0.82 | — | — | |
| Water SCHEMBL27434437 | 0.82 | — | — | |
| Water SCHEMBL15142099 | 0.82 | — | — | |
| Water SCHEMBL27827276 | 0.82 | — | — | |
| Water SCHEMBL15142096 | 0.82 | — | — | |
| Water SCHEMBL31733919 | 0.82 | — | — | |
| Water SCHEMBL28850234 | 0.82 | — | — | |
| Lithium Ion SCHEMBL6872479 | 0.82 | — | — | |
| Water SCHEMBL7157870 | 0.82 | — | — | |
| Water SCHEMBL28239581 | 0.82 | — | — |
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
Appears in 2603 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-117625965-B | Method for producing high-purity aluminum-niobium-tantalum intermediate alloy co-production ammonium fluoride | CHENGDE TIANDA VANADIUM INDUSTRY Co.,Ltd. (CN) | 2026-05-26 | — | — | CN | claimed |
| CN-122010177-A | Method for preparing ultra-high purity niobium oxide by deep desilication | 江西海协稀有金属材料有限公司 | 2026-05-12 | — | — | CN | claimed |
| CN-121575436-A | Double-site catalyst and preparation method and application thereof | 厦门大学 | 2026-02-27 | — | — | CN | claimed |
| EP-4636868-A1 | MODIFIED LITHIUM MANGANESE IRON PHOSPHATE POSITIVE ELECTRODE MATERIAL, AND PREPARATION METHOD THEREFOR AND USE THEREOF | Eve Power Co., Ltd. (CN) | 2025-10-22 | — | — | EP | claimed |
| EP-4600217-A1 | METHOD FOR PRODUCING METAL CARBIDE, METAL CARBIDE POWDER AND METAL CARBIDE INTERMEDIATE DISPERSED LIQUID | Mitsui Mining & Smelting Co., Ltd (JP) | 2025-08-13 | — | — | EP | claimed |
| WO-2025121753-A1 | METHOD FOR FORMING ELECTRON TRANSFER LAYER FOR PEROVSKITE SOLAR CELL AND METHOD FOR MANUFACTURING PEROVSKITE SOLAR CELL | 한화솔루션(주) | 2025-06-12 | — | — | WO | claimed |
| WO-2025120887-A1 | LITHIUM-ION BATTERY POSITIVE-ELECTRODE ACTIVE MATERIAL, LITHIUM-ION BATTERY POSITIVE ELECTRODE, LITHIUM-ION BATTERY, ALL-SOLID LITHIUM-ION BATTERY POSITIVE-ELECTRODE ACTIVE MATERIAL, ALL-SOLID LITHIUM-ION BATTERY POSITIVE ELECTRODE, ALL-SOLID LITHIUM-ION BATTERY, METHOD FOR MANUFACTURING LITHIUM-ION BATTERY POSITIVE-ELECTRODE ACTIVE MATERIAL, AND METHOD FOR MANUFACTURING ALL-SOLID LITHIUM-ION BATTERY POSITIVE-ELECTRODE ACTIVE MATERIAL | ＪＸ金属株式会社 | 2025-06-12 | — | — | WO | claimed |
| CN-120015826-A | Medium-entropy manganese-based phosphate sodium-electricity positive electrode material, and preparation method and application thereof | 武汉纺织大学 | 2025-05-16 | — | — | CN | claimed |
| CN-119943921-A | Ternary polycrystalline positive electrode material, preparation method thereof and lithium ion battery | 巴斯夫杉杉电池材料有限公司 | 2025-05-06 | — | — | CN | claimed |
| CN-119943897-A | Composite positive electrode material and preparation method and application thereof | 深圳市德方纳米科技股份有限公司 | 2025-05-06 | — | — | CN | claimed |
| US-5180699-A | Lead-niobium-metal oxide ceramic produced from a niobic acid sol | SAKAI CHEMICAL INDUSTRY CO., LTD. (JP) | 1993-01-19 | — | — | US | claimed |
| US-5102649-A | Reacting strong acid, hydrogen peroxide, and niobium compound | SAKAI CHEMICAL INDUSTRY CO. (JP) | 1992-04-07 | — | — | US | claimed |
| EP-0241278-B1 | METHOD OF SEPARATING AND PURIFYING TANTALUM AND NIOBIUM-CONTAINING COMPOUNDS | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1991-11-21 | — | — | EP | claimed |
| EP-0428388-A1 | Process for producing peroxoniobic acid sol | SAKAI CHEMICAL INDUSTRY CO., LTD., (JP) | 1991-05-22 | — | — | EP | claimed |
| EP-0428387-A2 | Process for producing powder material for lead perovskite ceramic | SAKAI CHEMICAL INDUSTRY CO., LTD., (JP) | 1991-05-22 | — | — | EP | claimed |
| EP-0271182-A1 | Alumina catalyst for catalytic production of methyl isobutyl ketone from acetone | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1988-06-15 | — | — | EP | claimed |
| CN-86107657-B | Production method of spherical niobium pentoxide | 北京有色金属研究总院 | 1988-01-13 | — | — | CN | claimed |
| CN-86107657-A | The production method of purification of spherical Niobium Pentxoxide | — | 1987-12-09 | — | — | CN | claimed |
| EP-0241278-A2 | Method of separating and purifying tantalum and niobium-containing compounds | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 1987-10-14 | — | — | EP | claimed |
| EP-0135145-A2 | Solid acid catalysts and process of producing the same | CBMM Internacional Ltda. (BR) | 1985-03-27 | — | — | EP | claimed |