SCHEMBL7765334

SCHEMBL7765334

CCN(CC)NCC(C)O

nearest known ligand 0.40

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TSHR P16473 2/20 0.40
TDP1 Q9NUW8 1/20 0.33
ALDH1A1 P00352 1/20 0.32

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
SCHEMBL17567122 0.81 TSHR (0.32) TSHRTDP1ALDH1A1
SCHEMBL27899062 0.79 TSHR (0.30) TSHR
SCHEMBL8442005 0.77 TDP1 (0.35) TDP1
SCHEMBL7261744 0.77 DNM1 (0.39)
SCHEMBL7257303 0.77 DNM1 (0.39)
SCHEMBL1903527 0.74
SCHEMBL27881660 0.74 ALDH1A1 (0.37) TSHRTDP1ALDH1A1
SCHEMBL27881656 0.70 ALDH1A1 (0.34) TSHRALDH1A1
Diisopropanolamine SCHEMBL9785649 0.70 TSHR (0.38) TSHRTDP1ALDH1A1
SCHEMBL12228087 0.69

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 13 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0580527-B2 Cationic surfactant compositions derived from mono or polyalkyl esters and/or amides of ammonium compounds and processes for their preparation STEPAN EUROPE (FR) 2001-06-27 EP claimed
EP-0580527-B1 Cationic surfactant compositions derived from mono or polyalkyl esters and/or amides of ammonium compounds and processes for their preparation STEPAN EUROPE (FR) 1997-10-29 EP claimed
EP-0550361-B1 Surface active quaternary ammonium compounds, processes for their preparation and softening compositions derived from them STEPAN EUROPE (FR) 1996-10-16 EP claimed
EP-0580527-A1 Cationic surfactant compositions derived from mono or polyalkyl esters or amides of ammonium compounds and processes for their preparation STEPAN EUROPE (FR) 1994-01-26 EP claimed
EP-0550361-A1 Surface active quaternary ammonium compounds, processes for their preparation and softening compositions derived from them STEPAN EUROPE (FR) 1993-07-07 EP claimed
CN-101835820-B Process for production of polyester-containing flexible polyurethane foam, and catalyst composition for use in the process TOSOH CORP 2012-11-21 CN disclosed
EP-0580527-B2 Cationic surfactant compositions derived from mono or polyalkyl esters and/or amides of ammonium compounds and processes for their preparation STEPAN EUROPE (FR) 2001-06-27 EP disclosed
US-5750492-A BIODEGRADABLE COMPOSITION FOR TEXTILES STEPAN EUROPE (FR) 1998-05-12 US disclosed
EP-0580527-B1 Cationic surfactant compositions derived from mono or polyalkyl esters and/or amides of ammonium compounds and processes for their preparation STEPAN EUROPE (FR) 1997-10-29 EP disclosed
US-5637743-A CATIONIC SURFACTANT STEPAN EUROPE (FR) 1997-06-10 US disclosed
EP-0550361-B1 Surface active quaternary ammonium compounds, processes for their preparation and softening compositions derived from them STEPAN EUROPE (FR) 1996-10-16 EP disclosed
EP-0580527-A1 Cationic surfactant compositions derived from mono or polyalkyl esters or amides of ammonium compounds and processes for their preparation STEPAN EUROPE (FR) 1994-01-26 EP disclosed
EP-0550361-A1 Surface active quaternary ammonium compounds, processes for their preparation and softening compositions derived from them STEPAN EUROPE (FR) 1993-07-07 EP disclosed