SCHEMBL1964576

SCHEMBL1964576

CCCCCCCCCCCCCCCCCC[N+](C)(C)CCOS(=O)(=O)OCC[N+](C)(C)CCCCCCCCCCCCCCCCCC

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 3/20 0.58
DNM1 Q05193 8/20 0.56
KMT2A Q03164 1/20 0.54
HSP90AA1 P07900 2/20 0.52
RAD52 P43351 2/20 0.52
MLNR O43193 1/20 0.47
NR1I2 O75469 1/20 0.47
ESR1 P03372 1/20 0.47
NR3C1 P04150 1/20 0.47
PGR P06401 1/20 0.47
ADRB2 P07550 1/20 0.47
CHRM2 P08172 1/20 0.47
ADRB1 P08588 1/20 0.47
HTR1A P08908 1/20 0.47
ADRA2A P08913 1/20 0.47
ADORA3 P0DMS8 1/20 0.47
CHRM1 P11229 1/20 0.47
DRD2 P14416 1/20 0.47
ADRA2B P18089 1/20 0.47
ADRA2C P18825 1/20 0.47

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
SCHEMBL11670838 0.85 DNM1 (0.55) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL8884249 0.85 DNM1 (0.55) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL16248893 0.85 DNM1 (0.55) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL10614393 0.85 RECQL (0.61) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL8441546 0.85 DNM1 (0.55) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL1964577 0.85 RECQL (0.61) HTTDNM1KMT2AHSP90AA1RAD52
SCHEMBL8440694 0.85 DNM1 (0.55) HTTDNM1KMT2AHSP90AA1RAD52
Bromide SCHEMBL10492585 0.84 DNM1 (0.57) HTTDNM1KMT2AHSP90AA1RAD52
Hydrochloric Acid SCHEMBL10492655 0.84 DNM1 (0.53) HTTDNM1KMT2AHSP90AA1RAD52
Hydrochloric Acid SCHEMBL10492606 0.84 DNM1 (0.53) HTTDNM1KMT2AHSP90AA1RAD52

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-8740993-B2 Method for reduced encrustation of textiles using a polymer comprising maleic acid, vinyl acetate, and alkyl acrylate ECOLAB USA INC. (US) 2014-06-03 US disclosed
US-20130252873-A1 METHOD FOR REDUCED ENCRUSTATION OF TEXTILES USING A POLYMER COMPRISING MALEIC ACID, VINYL ACETATE, AND ALKYL ACRYLATE ECOLAB USA INC. (US) 2013-09-26 US disclosed
US-20120252714-A1 Liquid Cleaning Compositions Containing Sulfonated Estolides and Polymeric Foam Builders STEPAN COMPANY 2012-10-04 US disclosed
WO-2011072232-A1 LIQUID CLEANING COMPOSITIONS CONTAINING SULFONATED ESTOLIDES AND POLYMERIC FOAM BUILDERS STEPAN COMPANY (US) 2011-06-16 WO disclosed
WO-2009065181-A1 NANOSTRUCTURES SUITABLE FOR DELIVERY OF AGENTS APOLLO LIFE SCIENCES LIMITED (AU) 2009-05-28 WO disclosed
WO-2008154705-A1 TRANSDERMAL DELIVERY OF ACTIVE AGENTS APOLLO LIFE SCIENCES LIMITED (AU) 2008-12-24 WO disclosed
WO-2007131286-A1 NANOSTRUCTURES SUITABLE FOR DELIVERY OF AGENTS APOLLO LIFE SCIENCES LIMITED (AU) 2007-11-22 WO disclosed
US-6387864-B1 LAUNDRY DETERGENT ECOLAB INC. 2002-05-14 US disclosed
US-4195077-A FOR PROTECTING KERATINOUS MATERIAL FROM DETERGENTS AND WEATHER THE PROCTER & GAMBLE COMPANY (US) 1980-03-25 US disclosed
US-4180472-A SPECIFIC MIXTURES OF SOLVENTS AND SOLVENT SOLUBLE EMULSIFIERS IN AQUEOUS WASHING MEDIUM THE PROCTER & GAMBLE COMPANY (US) 1979-12-25 US disclosed
US-4178254-A Fabric care compositions containing smectite clay and starch THE PROCTER & GAMBLE COMPANY (US) 1979-12-11 US disclosed
US-4176080-A SOLVENTS, WATER IN OIL EMULSIFIER, SURFACTANTS; LAUNDERING THE PROCTER & GAMBLE COMPANY (US) 1979-11-27 US disclosed
US-4174291-A DETERGENTS THE PROCTER & GAMBLE COMPANY (US) 1979-11-13 US disclosed
EP-0004111-A1 Fabric care compositions containing smectite clay and gelatinized vegetable starch THE PROCTER & GAMBLE COMPANY (US) 1979-09-19 EP disclosed
EP-0004109-A1 Liquid fabric care composition containing gelatinized vegetable starch, surfactant and electrolyte THE PROCTER & GAMBLE COMPANY (US) 1979-09-19 EP disclosed
US-4162983-A Fabric care composition containing starch and surfactant THE PROCTER & GAMBLE COMPANY (US) 1979-07-31 US disclosed
US-4115548-A PROTECTION OF KERATINOUS MATERIAL FROM EFFECTS OF DETERGENTS AND WEATHER THE PROCTER & GAMBLE COMPANY (US) 1978-09-19 US disclosed
US-4069066-A AMINE COMPOUNDS, METAL SALT THE PROCTER & GAMBLE COMPANY (US) 1978-01-17 US disclosed