SCHEMBL2165563

SCHEMBL2165563

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

nearest known ligand 0.46

Known targets — ChEMBL curated mechanism

ACHECHRM1CHRM3

The experimentally established mechanism targets of None. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CHRM1 known ✓ P11229 1/20 0.32
TSHR P16473 4/20 0.46
SLC22A16 Q86VW1 1/20 0.36
ALDH1A1 P00352 2/20 0.35
THRB P10828 1/20 0.33
MAPT P10636 2/20 0.33
CHRM2 P08172 1/20 0.32
CHRM4 P08173 1/20 0.32
TBXA2R P21731 1/20 0.32
MEN1 O00255 1/20 0.31
CYP1A2 P05177 1/20 0.31
HRH1 P35367 1/20 0.31
KMT2A Q03164 1/20 0.31
GALR3 O60755 1/20 0.31
BLM P54132 1/20 0.31
SMN1; SMN2 Q16637 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
Sulfuric Acid SCHEMBL8098694 0.92 TSHR (0.50) TSHRSLC22A16ALDH1A1THRBMAPT
Sulfuric Acid SCHEMBL8362452 0.91 TSHR (0.49) TSHRSLC22A16ALDH1A1THRBMAPT
SCHEMBL758619 0.87 TSHR (0.59) TSHRSLC22A16ALDH1A1THRBMAPT
Acetic Acid SCHEMBL22188618 0.85 TSHR (0.53) TSHRSLC22A16ALDH1A1THRBMAPT
Bromide SCHEMBL1254317 0.85 TSHR (0.57) TSHRSLC22A16ALDH1A1THRBMAPT
Fluoride Ion SCHEMBL1254970 0.85 TSHR (0.57) TSHRSLC22A16ALDH1A1THRBMAPT
Iodide SCHEMBL1255392 0.85 TSHR (0.57) TSHRSLC22A16ALDH1A1THRBMAPT
Hydrochloric Acid SCHEMBL204258 0.85 TSHR (0.57) TSHRSLC22A16ALDH1A1THRBMAPT
Hydrochloric Acid SCHEMBL534137 0.85 TSHR (0.57) TSHRSLC22A16ALDH1A1THRBMAPT
Chloromethane SCHEMBL10796929 0.84 TSHR (0.55) TSHRSLC22A16ALDH1A1THRBMAPT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003585-B2 Cationic polymers and fixative applications therefor LUBRIZOL ADVANCED MATERIALS, INC. (US) 2011-08-23 US disclosed
EP-2340263-A1 CATIONIC POLYMERS AND FIXATIVE APPLICATIONS THEREFOR Lubrizol Advanced Materials, Inc. (US) 2011-07-06 EP disclosed
WO-2010033302-A9 CATIONIC POLYMERS AND FIXATIVE APPLICATIONS THEREFOR LUBRIZOL ADVANCED MATERIALS, INC. (US) 2010-11-11 WO disclosed
US-20100284955-A1 Cationic Polymers And Fixative Applications Therefor LUBRIZOL ADVANCED MATERIALS, INC. (US) 2010-11-11 US disclosed
US-7759296-B2 Cationic polymers and fixative application therefor LUBRIZOL ADVANCED MATERIALS, INC. (US) 2010-07-20 US disclosed
WO-2010033302-A1 CATIONIC POLYMERS AND FIXATIVE APPLICATIONS THEREFOR LUBRIZOL ADVANCED MATERIALS, INC. (US) 2010-03-25 WO disclosed
US-20090010855-A1 Cationic Polymers And Fixative Applications Therefor LUBRIZOL ADVANCED MATERIALS, INC. (US) 2009-01-08 US disclosed
EP-0869169-B1 Detergent composition NAT STARCH AND CHEMICALINVEST (US) 2004-10-06 EP disclosed
EP-0879793-B1 A process for treating water to inhibit scale formation NAT STARCH AND CHEMICALINVEST (US) 2004-01-02 EP disclosed
EP-0608845-B1 Multifunctional maleate polymers NAT STARCH CHEM INVEST (US) 2003-07-02 EP disclosed
EP-0608845-A2 Multifunctional maleate polymers National Starch and Chemical Investment Holding Corporation (US) 1994-08-03 EP disclosed
US-5294692-A Butylene oxide-ethylene oxide copolymers modified with isocyanatoalkyl acrylates for coatings, sizing, drilling fluid or detergents NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1994-03-15 US disclosed
US-5180473-A Cationic Polymer Retention Aid MITSUI-CYANAMID, LTD. (JP) 1993-01-19 US disclosed
US-5132285-A Or enhancing water retention, graft copolymerizing a polysaccharide with a cationic/anionic monomer pair or a zwitterionic monomer, thermal initiator, dispersing resultant polyampholyte in aqueous media NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1992-07-21 US disclosed
US-5132284-A Thickeners, stabilizers; papermaking, oil drilling; guar gum NATIONAL STARCH AND CHEMICAL INVESTMENT HOLDING CORPORATION (US) 1992-07-21 US disclosed
EP-0216091-B1 INVERSE EMULSIONS National Starch and Chemical Investment Holding Corporation (US) 1992-05-06 EP disclosed
EP-0339372-A2 Method and composition for thickening or stabilizing aqueous media with polyamphoteric polysaccharides National Starch and Chemical Investment Holding Corporation (US) 1989-11-02 EP disclosed
US-4690996-A CONTAINING A POLYSACCHARIDE GRAFT COPOLYMER NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1987-09-01 US disclosed
US-4152307-A FLOCCULANTS SANYO CHEMICAL INDUSTRIES, LTD. (JP) 1979-05-01 US disclosed
US-4131576-A Process for the preparation of graft copolymers of a water soluble monomer and polysaccharide employing a two-phase reaction system NATIONAL STARCH AND CHEMICAL CORPORATION (US) 1978-12-26 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-20090010855-A1 Cationic Polymers And Fixative Applications Therefor CTSL, CATSPER1, HASPIN CHRM1 3219/4885TSHR 2175/4885SLC22A16 721/4885
US-20100284955-A1 Cationic Polymers And Fixative Applications Therefor CTSL, CATSPER1, HASPIN CHRM1 3219/4885TSHR 2175/4885SLC22A16 721/4885

“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.