SCHEMBL866754

SCHEMBL866754

C=C(C)C(=O)OCC[N+](C)(C)CCCS(=O)(=O)[O-]

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
BBOX1 O75936 2/20 0.47
TSHR P16473 3/20 0.41
THRB P10828 1/20 0.39
CHRM5 P08912 2/20 0.35
CHRM1 P11229 2/20 0.35
CHRM3 P20309 2/20 0.35
POLB P06746 2/20 0.33
APEX1 P27695 1/20 0.33
HTT P42858 1/20 0.33
TDP1 Q9NUW8 1/20 0.33
GALR3 O60755 1/20 0.33
PGR P06401 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
HTR1A P08908 1/20 0.33
CHRNB2 P17787 1/20 0.33
TBXA2R P21731 1/20 0.33
CHRNB4 P30926 1/20 0.33
CHRNA3 P32297 1/20 0.33
CHRNA7 P36544 1/20 0.33

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
SCHEMBL19547992 0.96 BBOX1 (0.42) BBOX1TSHRTHRBCHRM5CHRM1
SCHEMBL25625851 0.94 TSHR (0.43) BBOX1TSHRTHRBCHRM5CHRM1
SCHEMBL16799129 0.94 BBOX1 (0.47) BBOX1TSHRTHRBCHRM5CHRM1
SCHEMBL16799116 0.93 TSHR (0.47) BBOX1TSHRTHRBCHRM5CHRM1
SCHEMBL23628721 0.92 THRB (0.45) BBOX1TSHRTHRBPOLBAPEX1
SCHEMBL18151499 0.92 TSHR (0.50) BBOX1TSHRTHRBCHRM5CHRM1
SCHEMBL16799360 0.92 TSHR (0.50) BBOX1TSHRTHRBCHRM5CHRM1
SCHEMBL16798910 0.92 TSHR (0.50) BBOX1TSHRTHRBCHRM5CHRM1
SCHEMBL18151642 0.92 TSHR (0.50) BBOX1TSHRTHRBCHRM5CHRM1
SCHEMBL16799121 0.92 TSHR (0.50) BBOX1TSHRTHRBCHRM5CHRM1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-4743200-A2 SYSTEMS, METHODS, AND APPARATUSES FOR CARBON DIOXIDE CAPTURE Corning Incorporated (US) 2026-05-20 EP claimed
CN-122059447-A Preparation method and application of nano manganese oxide compound 山西大学 2026-05-19 CN claimed
CN-122010646-A Soil conditioner for water and soil conservation and preparation method thereof 国能神东煤炭集团有限责任公司 2026-05-12 CN claimed
EP-4732316-A1 MATERIALS AND METHODS OF PATHOGEN INACTIVATION C-Polar Technologies, Inc. (US) 2026-04-29 EP claimed
WO-2026042014-A1 A PHOTOCURABLE ACRYLATE RESIN MONOMER AND THE USE THEREOF LEVOBIO LIMITED (CN) 2026-02-26 WO claimed
US-20260035576-A1 ANTI-FOULING COATINGS FOR ELECTROCHEMICAL BIOSENSORS UNIV MCMASTER (CA) 2026-02-05 US claimed
US-20260015649-A1 REAGENT LAYER AND BIOSENSOR COMPRISING REAGENT LAYER PHC HOLDINGS CORPORATION (JP) 2026-01-15 US claimed
EP-4583229-A1 TWO-PHASE DECOUPLING EUTECTIC GEL ELECTROLYTE, AND PREPARATION METHOD THEREFOR AND USE THEREOF Zhengzhou University of Light Industry (CN) 2025-07-09 EP claimed
CN-120189548-A Medicine-carrying and body-externally-secretion gel skin wound dressing 湖南工业大学 2025-06-24 CN claimed
WO-2025122960-A1 ELECTROCHEMICAL LITHIUM EXTRACTION SYSTEM AND METHOD Lyten, Inc. (US) 2025-06-12 WO claimed
CN-114479793-A Composite plugging agent and preparation method and application thereof 中国石油化工股份有限公司 2022-05-13 CN claimed
CN-114479782-A Plugging agent and preparation method and application thereof 中国石油化工股份有限公司 2022-05-13 CN claimed
CN-114478960-A Plugging material and preparation method and application thereof 中国石油化工股份有限公司 2022-05-13 CN claimed
CN-114437679-A Water-based drilling fluid and preparation method and application thereof 中国石油化工股份有限公司 2022-05-06 CN claimed
CN-114437680-A Starch-based drilling fluid and preparation method thereof 中国石油化工股份有限公司 2022-05-06 CN claimed
CN-114212851-A Solar seawater desalination material based on natural plant rods and preparation method and application thereof 中国科学院化学研究所 2022-03-22 CN claimed
CN-111466367-B Composition for preserving cells 天津大学 2022-03-01 CN claimed
US-20200172741-A1 ANTIMICROBIAL AND ANTIFOULING CONFORMAL HYDROGEL COATINGS CORNELL UNIVERSITY 2020-06-04 US claimed
CN-103724557-B A kind of preparation method of ultra early-strength polycarboxylic admixture Jiangsu Subute New Materials Co., Ltd. (CN) 2016-05-11 CN claimed
CN-103724557-A Preparation method for super early-strength type poly carboxylic acid admixture JIANGSU SUBOTE NEW MAT CO LTD 2014-04-16 CN 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-20260035576-A1 ANTI-FOULING COATINGS FOR ELECTROCHEMICAL BIOSENSORS GJB2, SLC26A3, GJA1 BBOX1 1441/4885TSHR 752/4885THRB 1009/4885
US-20260015649-A1 REAGENT LAYER AND BIOSENSOR COMPRISING REAGENT LAYER LDHB, CA13, LDHA BBOX1 582/4885TSHR 2175/4885THRB 2617/4885

“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.