SCHEMBL844525

SCHEMBL844525

Nc1ccc(N)c(N(CCO)CCO)c1

nearest known ligand 0.35

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.35
MEN1 O00255 2/20 0.34
KMT2A Q03164 2/20 0.34
MAPT P10636 2/20 0.34
THRB P10828 2/20 0.34
RECQL P46063 2/20 0.34
TDP1 Q9NUW8 2/20 0.34
USP2 O75604 1/20 0.34
POLB P06746 1/20 0.34
PKM P14618 1/20 0.34
APEX1 P27695 1/20 0.34
BLM P54132 1/20 0.34
MCL1 Q07820 1/20 0.34
PABPC1 P11940 1/20 0.34
CASP1 P29466 2/20 0.33
CYP3A4 P08684 2/20 0.33
ALOX15 P16050 2/20 0.33
GAA P10253 1/20 0.33
HPGD P15428 1/20 0.33
TSHR P16473 1/20 0.33

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
SCHEMBL8640578 0.84 CASP1 (0.35) ALDH1A1MEN1KMT2AMAPTTHRB
SCHEMBL6752755 0.82 PRKCI (0.42) ALDH1A1MEN1KMT2AMAPTTHRB
SCHEMBL7784690 0.81 TDP1 (0.43) ALDH1A1MAPTTHRBTDP1PKM
SCHEMBL6571427 0.78 MEN1 (0.44) ALDH1A1MEN1KMT2AMAPTTHRB
SCHEMBL855950 0.77 PDE10A (0.44) ALDH1A1MEN1KMT2AMAPTTHRB
SCHEMBL855573 0.77 CA1 (0.44) ALDH1A1MEN1KMT2AMAPTTHRB
SCHEMBL7891011 0.77 CYP19A1 (0.44) ALDH1A1MAPTUSP2GAATSHR
Sulfuric Acid SCHEMBL7807208 0.77 ALDH1A1 (0.43) ALDH1A1MEN1KMT2AMAPTTHRB
SCHEMBL6572602 0.77 MEN1 (0.33) ALDH1A1MEN1KMT2ATDP1POLB
SCHEMBL6570840 0.76 ALDH1A1 (0.36) ALDH1A1MEN1KMT2AMAPTRECQL

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2433617-B1 Cosmetic composition containing microcapsules HENKEL AG & CO KGAA (DE) 2019-05-15 EP claimed
EP-1900393-B1 Hydrogen peroxide activation with diones and imidazoles HENKEL AG & CO KGAA (DE) 2018-02-28 EP claimed
EP-1862198-B1 Brightening and/or dyeing agent with urea derivatives HENKEL AG & CO KGAA (DE) 2017-04-05 EP claimed
EP-2173314-B1 VAPORIZER SOLUTION, AND DYEING METHOD HENKEL AG & CO KGAA (DE) 2014-07-23 EP claimed
EP-1871486-B1 OXIDATION DYES COMPRISING PERSULFATES AND/OR PEROXODISULFATES HENKEL AG & CO KGAA (DE) 2014-07-09 EP claimed
EP-2012742-B1 BLEACHING AND/OR COLOURING AGENTS CONTAINING PIPERIDONES HENKEL AG & CO KGAA (DE) 2014-03-19 EP claimed
EP-2689803-A2 Protective hair dye with block copolymers Henkel AG&Co. KGAA (DE) 2014-01-29 EP claimed
EP-2689773-A2 Protective hair dye with silicone block copolymers Henkel AG&Co. KGAA (DE) 2014-01-29 EP claimed
EP-2689804-A2 Protective hair dye with silicone(s) and polymer(s) Henkel AG&Co. KGAA (DE) 2014-01-29 EP claimed
WO-2013087469-A1 HAIR-PROTECTING HAIR COLORANTS AND PERMANENT WAVING COMPOSITIONS HENKEL AG & CO. KGAA (DE) 2013-06-20 WO claimed
WO-2007059822-A1 COSMETIC COMPOSITIONS CONTAINING ANIONIC SURFACTANT(S) AND IONIC LIQUIDS I HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-05-31 WO claimed
EP-1790328-A1 Cosmetic compositions comprising anionic detergents and ionic liquids HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-05-30 EP claimed
WO-2007048473-A1 HAIR COLOURING AND/OR LIGHTENING METHOD WITH IMPROVED EFFICIENCY ACHIEVED BY UV LIGHT HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-05-03 WO claimed
EP-1442014-B1 MANUFACTURE OF RETINOIDS DSM IP ASSETS BV (NL) 2007-03-21 EP claimed
WO-2007025750-A1 AGENTS FOR THE TREATMENT OF KERATIN FIBRES CONTAINING NANOSCALE CALCIUM SALTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-03-08 WO claimed
WO-2007006418-A1 IONIC-LIQUID-CONTAINING PRODUCTS FOR DYEING AND/OR BRIGHTENING KERATIN FIBRES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2007-01-18 WO claimed
WO-2006111255-A1 PASTE-LIKE HAIR TREATMENT AGENT COMPRISING CYCLIC CARBOXYLATE ESTERS AND SILICATES HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 2006-10-26 WO claimed
US-5741337-A Process for the oxidative dyeing of keratinous fibres with a composition which contains an oxidation dye precursor, a coupler, and an oxidant at an acidic pH L'OREAL (FR) 1998-04-21 US claimed
EP-0681829-B1 Oxidative dyeing composition for keratinous fibres OREAL (FR) 1996-10-09 EP claimed
US-4684371-A Oxidation hair dyes comprising m-phenylenediamine derivatives as coupling components HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1987-08-04 US claimed