SCHEMBL864650

SCHEMBL864650

C=C(CCC)C(=O)O.CCN(CC)CCCOS(=O)(=O)O

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FNTA P49354 2/20 0.38
FNTB P49356 2/20 0.38
PAOX Q6QHF9 1/20 0.36
NPSR1 Q6W5P4 2/20 0.34
ALDH1A1 P00352 3/20 0.34
APOBEC3A P31941 1/20 0.33
APOBEC3G Q9HC16 1/20 0.33
SCN1A P35498 2/20 0.33
SCN2A Q99250 2/20 0.33
SCN3A Q9NY46 2/20 0.33
CHRM2 P08172 1/20 0.33
CHRM4 P08173 1/20 0.33
CHRM1 P11229 1/20 0.33
CHRM3 P20309 1/20 0.33
CYP2D6 P10635 2/20 0.32
CYP3A4 P08684 2/20 0.32
LMNA P02545 2/20 0.32
KDM4E B2RXH2 1/20 0.32
CYP1A2 P05177 1/20 0.31
KDM5A P29375 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
SCHEMBL867364 0.87 FNTA (0.38) FNTAFNTBPAOXALDH1A1CYP2D6
SCHEMBL1573493 0.82 NPSR1 (0.46) FNTAFNTBPAOXNPSR1ALDH1A1
SCHEMBL864093 0.81 NPSR1 (0.36) PAOXNPSR1ALDH1A1APOBEC3AAPOBEC3G
SCHEMBL10893137 0.79 FFAR3 (0.30)
Sulfuric Acid SCHEMBL9179511 0.79 NPSR1 (0.45) PAOXNPSR1ALDH1A1APOBEC3AAPOBEC3G
SCHEMBL11699798 0.78 KDM4E (0.32) NPSR1ALDH1A1SCN1ASCN2ASCN3A
SCHEMBL9101444 0.77 FFAR3 (0.33) FNTAFNTBALDH1A1
SCHEMBL1706206 0.77 FNTA (0.49) FNTAFNTB
N,N-Dimethylethanaminium SCHEMBL4258892 0.77
N,N-Dimethylethanaminium SCHEMBL964537 0.77

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2132241-B1 COPOLYMER INCLUDING BETAININC UNITS AND HYDROPHOBIC AND/OR AMPHIPHILE UNITS, METHOD FOR PREPARING SAME AND USES THEREOF RHODIA OPERATIONS (FR) 2018-10-31 EP claimed
EP-2341986-A1 COSMETIC COMPOSITION CONTAINING AN AMPHIPHILIC ZWITTERIONIC COPOLYMER Rhodia Opérations (FR) 2011-07-13 EP claimed
EP-2025743-B1 Hard surface cleaning compostion PROCTER & GAMBLE (US) 2011-04-13 EP claimed
US-20110009309-A1 Hard Surface Cleaning Composition THE PROCTER & GAMBLE COMPANY 2011-01-13 US claimed
EP-2272942-A1 Hard surface cleaning composition The Procter & Gamble Company (US) 2011-01-12 EP claimed
EP-2176309-A2 COPOLYMER FOR IMPROVED DRYING Rhodia Opérations (FR) 2010-04-21 EP claimed
WO-2010040813-A1 COSMETIC COMPOSITION CONTAINING AN AMPHIPHILIC ZWITTERIONIC COPOLYMER RHODIA OPERATIONS (FR) 2010-04-15 WO claimed
EP-2132241-A1 COPOLYMER INCLUDING BETAININC UNITS AND HYDROPHOBIC AND/OR AMPHIPHILE UNITS, METHOD FOR PREPARING SAME AND USES THEREOF Rhodia Opérations (FR) 2009-12-16 EP claimed
EP-2025743-A1 Hard surface cleaning compostion The Procter and Gamble Company (US) 2009-02-18 EP claimed
US-20090029895-A1 HARD SURFACE CLEANING COMPOSITION THE PROCTER & GAMBLE COMPANY 2009-01-29 US claimed
WO-2009013283-A2 COPOLYMER FOR IMPROVED DRYING RHODIA OPERATIONS (FR) 2009-01-29 WO claimed
WO-2009013719-A1 HARD SURFACE CLEANING COMPOSITION THE PROCTER & GAMBLE COMPANY (US) 2009-01-29 WO claimed
WO-2008125512-A1 COPOLYMER INCLUDING BETAININC UNITS AND HYDROPHOBIC AND/OR AMPHIPHILE UNITS, METHOD FOR PREPARING SAME AND USES THEREOF RHODIA OPERATIONS (FR) 2008-10-23 WO claimed
EP-1966259-A1 COPOLYMER CONTAINING ZWITTERIONIC UNITS AND OTHER UNITS, COMPOSITION COMPRISING THE COPOLYMER, AND USE Rhodia Opérations (FR) 2008-09-10 EP claimed
WO-2007068744-A1 COPOLYMER CONTAINING ZWITTERIONIC UNITS AND OTHER UNITS, COMPOSITION COMPRISING THE COPOLYMER, AND USE RHODIA OPERATIONS (FR) 2007-06-21 WO claimed
EP-1694727-A2 ZWITTERIONIC POLYMERS COMPRISING BETAINE-TYPE UNITS AND USE OF ZWITTERIONIC POLYMERS IN DRILLING FLUIDS RHODIA CHIMIE (FR) 2006-08-30 EP claimed
WO-2005059860-A2 ZWITTERIONIC POLYMERS COMPRISING BETAINE-TYPE UNITS AND USE OF ZWITTERIONIC POLYMERS IN DRILLING FLUIDS RHODIA CHIMIE (FR) 2005-06-30 WO claimed
US-10252210-B2 Methods for reducing particulates in the air THE PROCTER & GAMBLE COMPANY (US) 2019-04-09 US disclosed
EP-1694727-A2 ZWITTERIONIC POLYMERS COMPRISING BETAINE-TYPE UNITS AND USE OF ZWITTERIONIC POLYMERS IN DRILLING FLUIDS RHODIA CHIMIE (FR) 2006-08-30 EP disclosed
WO-2005059860-A2 ZWITTERIONIC POLYMERS COMPRISING BETAINE-TYPE UNITS AND USE OF ZWITTERIONIC POLYMERS IN DRILLING FLUIDS RHODIA CHIMIE (FR) 2005-06-30 WO disclosed