SCHEMBL686653

SCHEMBL686653

C=CC(=O)NCC(CC)S(=O)(=O)O.[Na]

nearest known ligand 0.43

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
ZDHHC20 Q5W0Z9 1/20 0.43
ZDHHC2 Q9UIJ5 1/20 0.43
TSHR P16473 2/20 0.41
ALDH1A1 P00352 1/20 0.41
MAPK1 P28482 1/20 0.41
TDP1 Q9NUW8 1/20 0.41
TGM2 P21980 2/20 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
SCHEMBL28300 0.98 ZDHHC20 (0.44) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Ammonia Solution, Strong SCHEMBL139208 0.97 ZDHHC20 (0.43) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Hydrochloric Acid SCHEMBL28069295 0.97 ZDHHC20 (0.43) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Acrylic Acid SCHEMBL7528349 0.93 ZDHHC20 (0.41) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Acrylamide SCHEMBL8157330 0.92 ZDHHC20 (0.40) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL5668122 0.91 ZDHHC20 (0.39) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Methacrylic Acid SCHEMBL160887 0.89 TSHR (0.39) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL17171617 0.87 TSHR (0.48) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
Crotonic Acid SCHEMBL1001175 0.87 ZDHHC20 (0.36) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1
SCHEMBL6684578 0.84 ZDHHC20 (0.35) ZDHHC20ZDHHC2TSHRALDH1A1MAPK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1109750-B1 PROCESS AND PRODUCT FOR THE INHIBITION OF SCALE IN HARSH SYSTEMS NALCO CO (US) 2004-08-25 EP claimed
EP-0956275-B1 UTILITY OF WATER-SOLUBLE POLYMERS HAVING PENDANT DERIVATIZED AMIDE FUNCTIONALITIES AS CERAMICS DISPERSANTS AND BINDERS NALCO CHEMICAL CO (US) 2003-04-02 EP claimed
US-20020065358-A1 METHOD OF INHIBITING SCALE FORMATION USING WATER-SOLUBLE POLYMERS HAVING PENDANT DERIVATIZED AMIDE FUNCTIONALITIES NALCO CHEMICAL COMPANY 2002-05-30 US claimed
EP-1207143-A2 PREPARATION AND UTILITY OF WATER-SOLUBLE POLYMERS HAVING PENDANT DERIVATIZED AMIDE, ESTER OR ETHER FUNCTIONALITIES AS CERAMICS DISPERSANTS AND BINDERS NALCO CHEMICAL COMPANY (US) 2002-05-22 EP claimed
EP-0832854-B1 Method for inhibiting calcium carbonate scale by using sulfobetaine-containing polymers NALCO CHEMICAL CO (US) 2001-12-12 EP claimed
EP-1109750-A4 PROCESS FOR THE INHIBITION OF SCALE IN HARSH SYSTEMS AND NOVEL ANTISCALANTS FOR SAME NALCO CHEMICAL CO (US) 2001-12-05 EP claimed
US-20010035271-A1 Process for the inhibition of scale ONDEO NALCO COMPANY 2001-11-01 US claimed
EP-1109750-A1 PROCESS FOR THE INHIBITION OF SCALE IN HARSH SYSTEMS AND NOVEL ANTISCALANTS FOR SAME NALCO CHEMICAL COMPANY (US) 2001-06-27 EP claimed
US-6232419-B1 UNSATURATED POLYESTERS NALCO CHEMICAL COMPANY 2001-05-15 US claimed
US-6177017-B1 COMPLEXING WITH 1,4-DIAZABICYCLO(2.2.2) OCTANE POLYMERS NALCO CHEMICAL COMPANY 2001-01-23 US claimed
WO-2000012436-A1 PROCESS FOR THE INHIBITION OF SCALE IN HARSH SYSTEMS AND NOVEL ANTISCALANTS FOR SAME NALCO CHEMICAL COMPANY (US) 2000-03-09 WO claimed
US-6017994-A PREVENTING CORROSION AND SCALE DEPOSITION ON METAL SURFACES IN WATER SYSTEM BY TREATING WITH A WATER-SOLUBLE ACRYLAMIDES COPOLYMERS NALCO CHEMICAL COMPANY (US) 2000-01-25 US claimed
US-6005040-A PRECURSOR MATERIAL CONTAINING SELECTED CERAMIC POWDERS AND POLYMER; MIXING, DISPERSING, DRY PRESSING AND HEATING NALCO CHEMICAL COMPANY (US) 1999-12-21 US claimed
EP-0956275-A2 PREPARATION AND UTILITY OF WATER-SOLUBLE POLYMERS HAVING PENDANT DERIVATIZED AMIDE, ESTER OR ETHER FUNCTIONALITIES AS CERAMICS DISPERSANTS AND BINDERS NALCO CHEMICAL COMPANY (US) 1999-11-17 EP claimed
US-5880237-A POLYACRYLIC AMIDES FOR BINDING CERAMICS NALCO CHEMICAL COMPANY (US) 1999-03-09 US claimed
EP-0887316-A1 Utility of water-soluble polymers having pendant derivatized amide functionalities for scale control NALCO CHEMICAL COMPANY (US) 1998-12-30 EP claimed
WO-1998033750-A2 PREPARATION AND UTILITY OF WATER-SOLUBLE POLYMERS HAVING PENDANT DERIVATIZED AMIDE, ESTER OR ETHER FUNCTIONALITIES AS CERAMICS DISPERSANTS AND BINDERS NALCO CHEMICAL COMPANY (US) 1998-08-06 WO claimed
US-5788866-A PREVENT PRECIPITATION OF SCALE ON METAL SURFACES NALCO CHEMICAL COMPANY (US) 1998-08-04 US claimed
US-5726267-A POLYETHER-ACRYLIC AMIDE COPOLYMERS, BINDERS FOR CERAMICS, LOW VISCOSITY NALCO CHEMICAL COMPANY (US) 1998-03-10 US claimed
US-5025040-A Of water, hydraulic cement and a blend of acrylamide-vinylimidzole copolymer and acrylamide-vinylimidazole-acrylamidomethyl propane sulfonic acid sodium salt terpolymer BASF (US) 1991-06-18 US claimed