SCHEMBL855273

SCHEMBL855273

Nc1ccc(NCCCC(CCO)Nc2ccc(N)cc2)cc1

nearest known ligand 0.38

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
KCNH2 Q12809 9/20 0.38
PRSS1 P07477 7/20 0.37
APP P05067 1/20 0.36
F2 P00734 2/20 0.36
PRSS2 P07478 2/20 0.36
PRSS3 P35030 2/20 0.36
TMPRSS6 Q8IU80 2/20 0.36
ST14 Q9Y5Y6 2/20 0.36
TLR8 Q9NR97 1/20 0.36

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
SCHEMBL5157922 0.84 PRSS1 (0.40) PRSS1APPF2PRSS2PRSS3
Hydrochloric Acid SCHEMBL5428576 0.83 PRSS1 (0.41) PRSS1APPF2PRSS2PRSS3
SCHEMBL484007 0.82 MAPT (0.33) KCNH2APP
SCHEMBL6838626 0.80 MAPT (0.36) KCNH2TLR8
SCHEMBL28447576 0.78 MAPT (0.35) KCNH2APP
SCHEMBL145850 0.77 ALDH1A1 (0.47) PRSS1APPF2PRSS2PRSS3
SCHEMBL3857749 0.76 PRSS1 (0.38) PRSS1APPF2PRSS2PRSS3
SCHEMBL6228804 0.76 ALDH1A1 (0.55) PRSS1APPF2PRSS2PRSS3
Hydrochloric Acid SCHEMBL29162294 0.76 PRSS1 (0.48) PRSS1APPF2PRSS2PRSS3
Hydrochloric Acid SCHEMBL29722266 0.76 PRSS1 (0.48) PRSS1APPF2PRSS2PRSS3

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-1473025-B1 Dyeing composition containing 2-chloro-6-methyl-3-aminophenol and an associative polymer OREAL (FR) 2012-03-28 EP claimed
EP-0790818-B1 KERATIN FIBRE OXIDATION DYEING COMPOSITION AND DYEING METHOD USING SAME OREAL (FR) 2001-05-30 EP claimed
US-6733540-B2 FOR USE IN OXIDATION DYEING OF KERATINOUS FIBRES L'OREAL (FR) 2004-05-11 US disclosed
US-6551359-B1 Laccase, an oxidation color dye, and solvent selected from among certain polyols and their ethers; dyeing methods and kits L'OREAL S.A. (FR) 2003-04-22 US disclosed
US-20020100125-A1 Use of 2-(sulphonylamino) phenols as couplers in oxidation colouring L'OREAL (FR) 2002-08-01 US disclosed
US-6090159-A READY-TO-USE OXIDATION DYEING COMPOSITION COMPRISING AN OXIDATION BASE, SARCOSINE OXIDASE AS OXIDIZER, AND AT LEAST ONE DONOR FOR THE ENZYME; STRONGER COLORATION, NO BLEACHING L'OREAL (FR) 2000-07-18 US disclosed
EP-0428441-A2 Keratinic fibre dyeing compostions containing oxydation dye precursors and derivatives of 4-hydroxyindole as couplers, and dyeing process using same L'OREAL (FR) 1991-05-22 EP disclosed
EP-0428442-A1 Composition comprising derivatives of 6- or 7-hydroxyindole as couplers and dyeing processes using same L'OREAL (FR) 1991-05-22 EP disclosed
EP-0424261-A1 Dyeing composition containing oxidation dyes precursors and aminoindole derivatives as coupling agent L'OREAL (FR) 1991-04-24 EP disclosed