Water

Water

SCHEMBL45788

C=CC[N+](CC=C)(CC=C)CC=C.[OH-]

nearest known ligand 0.31

Full drug profile on Sugi Atlas →

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.

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.31
ALDH1A1 P00352 1/20 0.31

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

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.

Compoundsimilaritytop predictedshared targets
Potassium Ion SCHEMBL27358690 0.96
Water SCHEMBL6246044 0.96
Hydrogen Sulfide SCHEMBL28090943 0.96 TSHR (0.33) TSHRALDH1A1
SCHEMBL197824 0.96 TSHR (0.33) TSHRALDH1A1
Ammonia Solution, Strong SCHEMBL28002000 0.93
Water SCHEMBL11621604 0.93
Fluoride Ion SCHEMBL1260645 0.92 TSHR (0.31) TSHRALDH1A1
SCHEMBL596385 0.92 TSHR (0.31) TSHRALDH1A1
SCHEMBL5327324 0.92 TSHR (0.31) TSHRALDH1A1
Hydrochloric Acid SCHEMBL20896 0.92 TSHR (0.31) TSHRALDH1A1

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 15663 patents — a generic fragment claimed broadly, so it's down-weighted as IP noise. Top by claim status then date:

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-119898781-A Titanium-silicon molecular sieve and preparation method and application thereof 中国石油化工股份有限公司 2025-04-29 CN claimed
CN-119898780-A Titanium-silicon molecular sieve, preparation method thereof and application thereof in catalyzing organic matter reaction 中国石油化工股份有限公司 2025-04-29 CN claimed
CN-119430215-A Titanium-silicon molecular sieve material and preparation method and application thereof 中国石油化工股份有限公司 2025-02-14 CN claimed
US-12044974-B2 Compositions for removing photoresists and methods of manufacturing semiconductor devices and semiconductor packages using the compositions SAMSUNG ELECTRONICS CO., LTD. (KR) 2024-07-23 US claimed
CN-118339246-A Chemical mechanical planarization polishing composition for silicon oxide and silicon nitride 弗萨姆材料美国有限责任公司 2024-07-12 CN claimed
CN-116217338-B Method for chemically recycling polyvinyl chloride resin by supercritical method 内蒙古鄂尔多斯电力冶金集团股份有限公司 2024-07-12 CN claimed
CN-118318015-A In-bottle Pad (PIB) chemical mechanical planarization polishing using economical non-porous solid polishing pads 弗萨姆材料美国有限责任公司 2024-07-09 CN claimed
US-20240218250-A1 WET ANISOTROPIC ETCHING OF SILICON TEXAS INSTRUMENTS INC (US) 2024-07-04 US claimed
EP-4393019-A1 METAL FLUORIDE-FUNCTIONALIZED PROTON EXCHANGE SOLID SUPPORTS, MEMBRANES, AND IONOMERS 1S1 Energy, Inc. (US) 2024-07-03 EP claimed
US-12024471-B2 Ceramic slurry composition and process for producing stacked ceramic component BYK-CHEMIE GMBH (DE) 2024-07-02 US claimed
EP-0037271-A1 Indole derivatives and process for preparing the same TORAY INDUSTRIES, INC. (JP) 1981-10-07 EP claimed
EP-0033049-A1 Novel linear hydroquinone phenoxy polymers, process for making them and use as blends with polyesters to obtain laminated films EASTMAN KODAK COMPANY (a New Jersey corporation) (US) 1981-08-05 EP claimed
US-4267301-A Linear hydroquinone phenoxy polymers and process EASTMAN KODAK COMPANY (US) 1981-05-12 US claimed
US-4255596-A AND ETHYLBENZENE HYDROPEROXIDE, WATER, OSMIUM TETROXIDE CATALYST AND TETRAALKYLAMMONIUM HYDROXIDE PHASE TRANSFER AGENT GULF RESEARCH & DEVELOPMENT COMPANY (US) 1981-03-10 US claimed
US-4255599-A OXIDIZED TO ETHYLBENZENE HYDROPEROXIDE INTERMEDIATE, DECOMPOSED WITH ETHYLENE OR PROPYLENE USING OSMIUM TETROXIDE AND PHASE TRANSFER AGENT GULF RESEARCH & DEVELOPMENT COMPANY (US) 1981-03-10 US claimed
US-4239686-A Process for producing phthalimido derivatives ASAHI KASEI KOGYO KABUSHIKI KAISHA (JP) 1980-12-16 US claimed
US-4187156-A ELECTROLYTIC REDUCTION MONSANTO COMPANY (US) 1980-02-05 US claimed
US-4153768-A Organic hydroxy silicates utilized as curing agents for polyurethane prepolymers BLOUNT DAVID H 1979-05-08 US claimed
US-4042545-A Novel printing inks for sublimation transfer printing CIBA-GEIGY AG (CH) 1977-08-16 US claimed
US-3961991-A METHOD FOR CHEMICAL TREATMENT OF THE SURFACE OF AN IRON SUBSTRATE WITH PHOSPHORIC ACID SOLUTIONS NIPPON PAINT CO., LTD. (JA) 1976-06-08 US claimed