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 | |
|---|---|---|---|---|
| Hydrochloric Acid SCHEMBL5091821 | 0.90 | — | — | |
| Fluoride Ion SCHEMBL31683007 | 0.90 | — | — | |
| Bromide SCHEMBL5085474 | 0.90 | — | — | |
| Iodide SCHEMBL5092638 | 0.90 | — | — | |
| SCHEMBL9499028 | 0.82 | — | — | |
| SCHEMBL1719126 | 0.79 | TSHR (0.35) | — | |
| Water SCHEMBL31683014 | 0.76 | — | — | |
| Water SCHEMBL8394148 | 0.74 | — | — | |
| SCHEMBL12097988 | 0.73 | ALDH1A1 (0.46) | — | |
| SCHEMBL29624055 | 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 30 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-8034967-B2 | Method of preparing a purified ester-substituted phenol stream | Sabic Innnovative Plastics IP B.V. (NL) | 2011-10-11 | — | — | US | claimed |
| EP-2215045-B1 | METHOD OF PREPARING A PURIFIED ESTER-SUBSTITUTED PHENOL STREAM | SABIC INNOVATIVE PLASTICS IP (NL) | 2011-08-03 | — | — | EP | claimed |
| EP-2215045-A2 | METHOD OF PREPARING A PURIFIED ESTER-SUBSTITUTED PHENOL STREAM | SABIC Innovative Plastics IP B.V. (NL) | 2010-08-11 | — | — | EP | claimed |
| US-20090143610-A1 | Method of preparing a purified ester-substituted phenol stream | SABIC INNOVATIVE PLASTICS IP BV (US) | 2009-06-04 | — | — | US | claimed |
| WO-2009069079-A2 | METHOD OF PREPARING A PURIFIED ESTER-SUBSTITUTED PHENOL STREAM | SABIC INNOVATIVE PLASTICS IP B.V. (NL) | 2009-06-04 | — | — | WO | claimed |
| US-7498399-B2 | Method of preparing ester-substituted diaryl carbonates | SABIC INNOVATIVE PLASTICS IP B.V. (NL) | 2009-03-03 | — | — | US | claimed |
| EP-2021315-A1 | METHOD OF PREPARING ESTER-SUBSTITUTED DIARYL CARBONATES | Sabic Innovative Plastics IP B.V. (NL) | 2009-02-11 | — | — | EP | claimed |
| WO-2007143319-A1 | METHOD OF PREPARING ESTER-SUBSTITUTED DIARYL CARBONATES | SABIC INNOVATIVE PLASTICS IP B.V. (NL) | 2007-12-13 | — | — | WO | claimed |
| US-20070282091-A1 | Method of preparing ester-substituted diaryl carbonates | GENERAL ELECTRIC COMPANY (US) | 2007-12-06 | — | — | US | claimed |
| US-20260071095-A1 | POLISHING COMPOSITION, POLISHING METHOD, AND METHOD FOR PRODUCING SEMICONDUCTOR SUBSTRATE | FUJIMI INCORPORATED (JP) | 2026-03-12 | — | — | US | disclosed |
| US-20250320381-A1 | POLISHING COMPOSITION, POLISHING METHOD, AND METHOD FOR MANUFACTURING SEMICONDUCTOR SUBSTRATE | FUJIMI INCORPORATED (JP) | 2025-10-16 | — | — | US | disclosed |
| US-20250282977-A1 | POLISHING COMPOSITION, POLISHING METHOD, AND METHOD FOR MANUFACTURING SEMICONDUCTOR SUBSTRATE | FUJIMI INCORPORATED (JP) | 2025-09-11 | — | — | US | disclosed |
| US-11085011-B2 | Post CMP cleaning compositions for ceria particles | ENTEGRIS, INC. (US) | 2021-08-10 | — | — | US | disclosed |
| CN-112771144-A | POST chemical mechanical polishing (POST CMP) cleaning composition for cerium particles | 恩特格里斯公司 | 2021-05-07 | — | — | CN | disclosed |
| US-20070282091-A1 | Method of preparing ester-substituted diaryl carbonates | GENERAL ELECTRIC COMPANY (US) | 2007-12-06 | — | — | US | disclosed |
| WO-2003029338-A1 | COMPOUNDS BASED ON POLYORGANOSILOXANES, METHODS FOR PRODUCTION AND USE THEREOF | GE BAYER SILICONES GMBH & CO. KG (DE) | 2003-04-10 | — | — | WO | disclosed |
| US-4148696-A | Electrochemical oxidation of activated alkyl aromatic compounds | UOP INC. (US) | 1979-04-10 | — | — | US | disclosed |
| US-4104141-A | Electrochemical oxidation of alkoxy-substituted aromatic compounds | UOP INC. (US) | 1978-08-01 | — | — | US | disclosed |
| US-4089757-A | Electrochemical oxidation of alkoxy-substituted aromatic compounds | UOP INC. (US) | 1978-05-16 | — | — | US | disclosed |
| US-4076648-A | LIPOPHILIC NONIONIC SURFACTANT DISPERSED IN A NON-EMULSIFIED POLYSILOXANE | UNION CARBIDE CORPORATION (US) | 1978-02-28 | — | — | US | disclosed |