Water

Water

SCHEMBL4899700

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

nearest known ligand 0.54

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
TSHR P16473 7/20 0.54
CHRM5 P08912 6/20 0.54
CHRM1 P11229 6/20 0.54
CHRM3 P20309 6/20 0.54
CHRM2 P08172 5/20 0.54
CHRM4 P08173 5/20 0.54
CHRNB2 P17787 4/20 0.54
CHRNA4 P43681 4/20 0.54
ALDH1A1 P00352 3/20 0.54
CHRNA7 P36544 3/20 0.54
TP53 P04637 2/20 0.54
HIF1A Q16665 2/20 0.54
HTR1A P08908 2/20 0.54
SMN1; SMN2 Q16637 2/20 0.54
ADRA2A P08913 1/20 0.54
ADRA1A P35348 1/20 0.54
CYP3A4 P08684 1/20 0.54
PGR P06401 1/20 0.54
TBXA2R P21731 1/20 0.54
CHRNB4 P30926 1/20 0.54

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
SCHEMBL20908 0.98 TSHR (0.56) TSHRCHRM5CHRM1CHRM3CHRM2
SCHEMBL25422044 0.98 TSHR (0.56) TSHRCHRM5CHRM1CHRM3CHRM2
Fluoride Ion SCHEMBL1254299 0.96 TSHR (0.54) TSHRCHRM5CHRM1CHRM3CHRM2
Hydrochloric Acid SCHEMBL28367647 0.96 TSHR (0.54) TSHRCHRM5CHRM1CHRM3CHRM2
Iodide SCHEMBL1254880 0.96 TSHR (0.54) TSHRCHRM5CHRM1CHRM3CHRM2
Bromide SCHEMBL1254964 0.96 GALR3 (0.57) TSHRCHRM5CHRM1CHRM3CHRM2
Hydrochloric Acid SCHEMBL15738807 0.96 TSHR (0.54) TSHRCHRM5CHRM1CHRM3CHRM2
Hydrochloric Acid SCHEMBL134541 0.96 CHRM5 (0.57) TSHRCHRM5CHRM1CHRM3CHRM2
SCHEMBL1703727 0.96 TSHR (0.54) TSHRCHRM5CHRM1CHRM3CHRM2
Hydrochloric Acid SCHEMBL22128460 0.94 TSHR (0.52) TSHRCHRM5CHRM1CHRM3CHRM2

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 18 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-12618000-B2 Friction reduction of acidic treatment fluids HALLIBURTON ENERGY SERVICES, INC. (US) 2026-05-05 US disclosed
US-20260071533-A1 TREATMENT FLUID SELECTION HALLIBURTON ENERGY SERVICES, INC. (US) 2026-03-12 US disclosed
US-12247165-B2 Anti-syneresis agents for fracturing operations HALLIBURTON ENERGY SERVICES, INC. (US) 2025-03-11 US disclosed
US-20250075122-A1 ADDITIVES TO PREVENT THERMAL THINNING IN POLYMER GEL SYSTEMS HALLIBURTON ENERGY SERVICES, INC. (US) 2025-03-06 US disclosed
US-20250051634-A1 ANTI-SYNERESIS AGENTS FOR FRACTURING OPERATIONS HALLIBURTON ENERGY SERVICES, INC. (US) 2025-02-13 US disclosed
US-20250051635-A1 FRICTION REDUCTION OF ACIDIC TREATMENT FLUIDS HALLIBURTON ENERGY SERVICES, INC. (US) 2025-02-13 US disclosed
WO-2025006003-A1 FRICTION REDUCTION OF ACIDIC TREATMENT FLUIDS HALLIBURTON ENERGY SERVICES, INC. (US) 2025-01-02 WO disclosed
US-12139667-B1 Friction reduction of acidic treatment fluids HALLIBURTON ENERGY SERVICES, INC. (US) 2024-11-12 US disclosed
WO-2016066633-A1 NEW FILTRATION PROCESSES BASF SE (DE) 2016-05-06 WO disclosed
US-9321869-B2 Cationic polymers BASF SE (DE) 2016-04-26 US disclosed
US-9057959-B2 Developer for photosensitive resist material and patterning process SHIN-ETSU CHEMICAL CO., LTD. (JP) 2015-06-16 US disclosed
US-20150087796-A1 NEW CATIONIC POLYMERS BASF SE (DE) 2015-03-26 US disclosed
EP-2836525-A1 NEW CATIONIC POLYMERS BASF SE (DE) 2015-02-18 EP disclosed
US-20140377706-A1 DEVELOPER FOR PHOTOSENSITIVE RESIST MATERIAL AND PATTERNING PROCESS SHIN-ETSU CHEMICAL CO., LTD. (JP) 2014-12-25 US disclosed
CN-104245763-A New cationic polymers BASF SE 2014-12-24 CN disclosed
US-20130274369-A1 NEW CATIONIC POLYMERS BASF SE (DE) 2013-10-17 US disclosed
WO-2013153004-A1 NEW CATIONIC POLYMERS BASF SE (DE) 2013-10-17 WO disclosed
US-20080035344-A1 DELAYED POLYACRYLAMIDE-CO-ALUMINUM HYDROXYL CHLORIDE GEL SCHLUMBERGER TECHNOLOGY CORPORATION 2008-02-14 US disclosed

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-20260071533-A1 TREATMENT FLUID SELECTION PLG, SOST, CSTB TSHR 1255/4885CHRM5 3070/4885CHRM1 2745/4885
US-12618000-B2 Friction reduction of acidic treatment fluids GFER, FGB, NSF TSHR 1564/4885CHRM5 4511/4885CHRM1 4594/4885

“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.