SCHEMBL4387665

SCHEMBL4387665

CCN(CC)CCCCCCCCCCCCCCCNC(CC(N)=O)C(=O)O

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
HTT P42858 1/20 0.44
PAOX Q6QHF9 1/20 0.41
LMNA P02545 1/20 0.40
NOD1 Q9Y239 1/20 0.37
ALDH1A1 P00352 1/20 0.37
NPSR1 Q6W5P4 1/20 0.36
ECE1 P42892 2/20 0.35
APP P05067 2/20 0.33
TSHR P16473 1/20 0.33
GAA P10253 1/20 0.33
KDM5A P29375 1/20 0.33
KDM4C Q9H3R0 1/20 0.33
FOLH1 Q04609 1/20 0.32
SIRT2 Q8IXJ6 1/20 0.32
KDM4E B2RXH2 1/20 0.32
NPC1 O15118 1/20 0.32
SLC22A1 O15245 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
SCHEMBL28964751 0.94 HTT (0.48) HTTPAOXLMNANOD1ALDH1A1
SCHEMBL28964754 0.94 HTT (0.48) HTTPAOXLMNANOD1ALDH1A1
SCHEMBL1990412 0.83 NOD1 (0.50) LMNANOD1ECE1
SCHEMBL10927913 0.83 NOD1 (0.50) LMNANOD1ECE1
SCHEMBL210540 0.83 NOD1 (0.50) LMNANOD1ECE1
SCHEMBL10931833 0.83 NOD1 (0.50) LMNANOD1ECE1
SCHEMBL10931822 0.83 NOD1 (0.50) LMNANOD1ECE1
SCHEMBL11423025 0.83 NOD1 (0.50) LMNANOD1ECE1
SCHEMBL10927907 0.83 NOD1 (0.50) LMNANOD1ECE1
SCHEMBL28471576 0.83 NOD1 (0.50) LMNANOD1ECE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3999188-B1 COSMETIC COMPOSITION COMPRISING ANIONIC AND AMPHOTERIC SURFACTANTS, CATIONIC POLYSACCHARIDES AND UNSATURATED FATTY ALCOHOLS, AND COSMETIC TREATMENT PROCESS OREAL (FR) 2024-02-28 EP claimed
EP-2841167-B1 DYEING PROCESS USING A MIXTURE OBTAINED FROM AN AEROSOL DEVICE COMPRISING A LIQUID FATTY ALCOHOL AND SURFACTANTS L'ORÉAL (FR) 2017-06-14 EP claimed
EP-1404762-B1 A METHOD OF COLORING HAIR USING CATIONIC DYES BASF SE (DE) 2009-11-25 EP disclosed
US-7211118-B2 Composition for dyeing keratin fibers comprising a defined triheteroylmethane direct dye or leuco precursor of this dye and dyeing method using it L'OREAL S.A. (FR) 2007-05-01 US disclosed
US-7078498-B2 Method of coloring hair using cationic dyes CIBE SPECIALTY CHEMICALS CORPORATION (US) 2006-07-18 US disclosed
US-6949630-B2 Cationic reactive dyes CIBA SPECIALTY CHEMICALS CORPORATION (US) 2005-09-27 US disclosed
EP-1404762-A1 A METHOD OF COLORING HAIR USING CATIONIC DYES Ciba SC Holding AG (CH) 2004-04-07 EP disclosed
WO-2003006554-A1 A METHOD OF COLORING HAIR USING CATIONIC DYES CIBA SPECIALTY CHEMICALS HOLDING INC. (CH) 2003-01-23 WO disclosed
US-5518505-A Compositions and methods for the dyeing of keratinous fibers with oxidation dye precursors, indole derivative couplers and oxidizing agents L'OREAL (FR) 1996-05-21 US disclosed