Water

Water

SCHEMBL1040437

C[N+](C)(CCO)CCO.[OH-]

nearest known ligand 0.65

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 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 5/20 0.57
MEN1 O00255 1/20 0.53
LMNA P02545 1/20 0.53
KMT2A Q03164 1/20 0.53
CYP3A4 P08684 1/20 0.53
SLC5A7 Q9GZV3 1/20 0.53
PSMD14 O00487 1/20 0.37
PLA2G1B P04054 1/20 0.37
HSP90AA1 P07900 1/20 0.37
MMP2 P08253 1/20 0.37
ATG4B Q9Y4P1 1/20 0.37
APAF1 O14727 1/20 0.34
POLB P06746 1/20 0.34
GRK2 P25098 1/20 0.34
DNMT1 P26358 1/20 0.34
PTPN7 P35236 1/20 0.34
RECQL P46063 1/20 0.34
BLM P54132 1/20 0.34
PPP1CA P62136 1/20 0.34
CTDSP1 Q9GZU7 1/20 0.34

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
Water SCHEMBL11037762 0.96 DNM1 (0.55) DNM1MEN1LMNAKMT2ACYP3A4
SCHEMBL187428 0.96
SCHEMBL10415439 0.96 DNM1 (0.60) DNM1MEN1LMNAKMT2ACYP3A4
Hydrochloric Acid SCHEMBL156326 0.92 CYP3A4 (0.62) DNM1MEN1LMNAKMT2ACYP3A4
Iodide SCHEMBL2911216 0.92 DNM1 (0.57) DNM1MEN1LMNAKMT2ACYP3A4
SCHEMBL10415438 0.92 DNM1 (0.57) DNM1MEN1LMNAKMT2ACYP3A4
Bromide SCHEMBL2916839 0.92 MEN1 (0.62) DNM1MEN1LMNAKMT2ACYP3A4
SCHEMBL10002124 0.92 DNM1 (0.57) DNM1MEN1LMNAKMT2ACYP3A4
Fluoride Ion SCHEMBL11797943 0.92 DNM1 (0.57) DNM1MEN1LMNAKMT2ACYP3A4
Water SCHEMBL11782804 0.90 DNM1 (0.50) DNM1MEN1LMNAKMT2ACYP3A4

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 929 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20260042976-A1 COMPOSITIONS AND METHODS OF USE THEREOF FUJIFILM ELECTRONIC MAT USA INC (US) 2026-02-12 US claimed
US-12312569-B2 Kit for cleaning agent and method for preparing cleaning agent FUJIFILM CORPORATION (JP) 2025-05-27 US claimed
US-12292689-B2 Alkaline cleaning composition, cleaning method, and manufacturing method of semiconductor DAXIN MATERIALS CORPORATION (TW) 2025-05-06 US claimed
CN-114672378-B Alkaline cleaning composition, cleaning method and semiconductor manufacturing method 达兴材料股份有限公司 2024-08-13 CN claimed
US-20240262964-A1 METHOD OF PRODUCING SILICONE POLYMER TORAY FINE CHEMICALS CO., LTD. (JP) 2024-08-08 US claimed
CN-118092091-A Reducing chip photoresist stripping liquid, preparation method and application thereof 浙江奥首材料科技有限公司 2024-05-28 CN claimed
EP-4361201-A1 METHOD FOR PRODUCING SILICONE POLYMER Toray Fine Chemicals Co., Ltd. (JP) 2024-05-01 EP claimed
CN-117413005-A Process for producing siloxane polymer 东丽精细化工株式会社 2024-01-16 CN claimed
US-20230420266-A1 COMPOSITION FOR TREATING SEMICONDUCTOR AND METHOD FOR TREATING OBJECT TO BE TREATED FUJIFILM CORPORATION (JP) 2023-12-28 US claimed
EP-3037889-B1 MEMBER FOR ELECTROPHOTOGRAPHY AND METHOD OF PRODUCING THE MEMBER, PROCESS CARTRIDGE, AND ELECTROPHOTOGRAPHIC APPARATUS CANON KK (JP) 2023-11-29 EP claimed
US-20070100153-A1 PROCESS FOR PREPARING ORGANICALLY MODIFIED POLYORGANOSILOXANES GOLDSCHMIDT GMBH (DE) 2007-05-03 US claimed
EP-1135330-A4 SYNTHESIS OF AND COMPOSITIONS OF ECR-40, LARGE PORE ALUMINOPHOSPHATE EXXONMOBIL RES & ENG CO (US) 2005-11-16 EP claimed
US-20030171239-A1 Methods and compositions for chemically treating a substrate using foam technology EKC TECHNOLOGY, INC. 2003-09-11 US claimed
WO-2003064581-A1 METHODS AND COMPOSITIONS FOR CHEMICALLY TREATING A SUBSTRATE USING FOAM TECHNOLOGY EKC TECHNOLOGY, INC. (US) 2003-08-07 WO claimed
US-6379500-B2 Silica-based sols AKZO NOBEL NV (NL) 2002-04-30 US claimed
EP-1135330-A1 SYNTHESIS OF AND COMPOSITIONS OF ECR-40, LARGE PORE ALUMINOPHOSPHATE ExxonMobil Research and Engineering Company (US) 2001-09-26 EP claimed
US-20010004927-A1 Aqueous silica-based sol comprising a nitrogen-containing organic compound and silica-based particles with a specific surface area of atleast 300 square meters/gram of silica having S-valule 10-60% AKZO NOBEL NV (NL) 2001-06-28 US claimed
WO-2000021884-A1 SYNTHESIS OF AND COMPOSITIONS OF ECR-40, LARGE PORE ALUMINOPHOSPHATE EXXON RESEARCH AND ENGINEERING COMPANY (US) 2000-04-20 WO claimed
US-5976491-A Synthesis of and composition of ECR-40, large pore aluminophosphate EXXON RESEARCH AND ENGINEERING CO. (US) 1999-11-02 US claimed
EP-0267437-A2 Means and process for the removal of photo-resists SCHERING AKTIENGESELLSCHAFT (DE) 1988-05-18 EP claimed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (2 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070100153-A1 PROCESS FOR PREPARING ORGANICALLY MODIFIED POLYORGANOSILOXANES ADH1C, ADH1A, SORD DNM1 389/4885MEN1 2025/4885LMNA 1946/4885
US-20260042976-A1 COMPOSITIONS AND METHODS OF USE THEREOF ACP1, PLOD1, CA1 DNM1 2769/4885MEN1 2500/4885LMNA 3360/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.