SCHEMBL4408209

SCHEMBL4408209

NNc1ccc(N(CCO)CCO)cc1

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 4/20 0.39
TDP1 Q9NUW8 3/20 0.39
KDM4E B2RXH2 2/20 0.39
ADRA2A P08913 1/20 0.37
TSHR P16473 1/20 0.36
BACE1 P56817 3/20 0.36
KMT2A Q03164 5/20 0.36
MAPT P10636 4/20 0.36
MEN1 O00255 3/20 0.36
LMNA P02545 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
IDO1 P14902 1/20 0.36
CYP2C19 P33261 1/20 0.36
PTGS2 P35354 1/20 0.36
SMN1; SMN2 Q16637 2/20 0.35
TP53 P04637 1/20 0.35
ATM Q13315 1/20 0.35

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
SCHEMBL10153024 0.89 MAPT (0.45) ALDH1A1TDP1KDM4ETSHRKMT2A
SCHEMBL6243535 0.82 MAPT (0.44) ALDH1A1TDP1ADRA2ATSHRBACE1
Hydrochloric Acid SCHEMBL8038931 0.79 MAPT (0.43) ALDH1A1TDP1KDM4ETSHRBACE1
SCHEMBL10105249 0.79 ALDH1A1 (0.39) ALDH1A1TDP1KDM4EADRA2ATSHR
SCHEMBL3202085 0.79 KMT2A (0.39) ALDH1A1TDP1KDM4EADRA2ATSHR
SCHEMBL9022771 0.78 ALDH1A1 (0.53) ALDH1A1TDP1KDM4ETSHRBACE1
SCHEMBL11682442 0.76 ALDH1A1 (0.50) ALDH1A1TDP1TSHRKMT2AMAPT
SCHEMBL28087334 0.76 ALDH1A1 (0.54) ALDH1A1TDP1KDM4EADRA2ATSHR
SCHEMBL33874 0.76 ALDH1A1 (0.54) ALDH1A1TDP1KDM4EADRA2ATSHR
SCHEMBL8521178 0.76 ALDH1A1 (0.54) ALDH1A1TDP1KDM4EADRA2ATSHR

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 29 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-2012742-B1 BLEACHING AND/OR COLOURING AGENTS CONTAINING PIPERIDONES HENKEL AG & CO KGAA (DE) 2014-03-19 EP claimed
EP-1859782-B1 Composition for coloring and/or lightening human hair comprising tetrazoles HENKEL AG & CO KGAA (DE) 2009-12-30 EP claimed
US-10835478-B2 Lightening method using special siloxane compounds HENKEL AG & CO. KGAA (DE) 2020-11-17 US disclosed
US-10328016-B2 Dye composition with special non-ionic linear silicone polymers HENKEL AG & CO. KGAA (DE) 2019-06-25 US disclosed
US-10117825-B2 Oxidation coloring composition with protein-siloxane polymers HENKEL AG & CO. KGAA (DE) 2018-11-06 US disclosed
US-10092502-B2 Oxidative hair lighteners with special aminated silicone polymers HENKEL AG & CO. KGAA (DE) 2018-10-09 US disclosed
US-10080716-B2 Packaging unit having particular aminated silicone polymer HENKEL AG & CO. KGAA (DE) 2018-09-25 US disclosed
US-20180221269-A1 LIGHTENING METHOD USING SPECIAL SILOXANE COMPOUNDS HENKEL AG & CO. KGAA (DE) 2018-08-09 US disclosed
US-10039707-B2 Oxidation dyeing agent having specific non-ionic silicone polymers HENKEL AG & CO. KGAA (DE) 2018-08-07 US disclosed
US-20170100322-A1 HAIR DYE WITH CATIONIC POLYMER HENKEL AG & CO. KGAA (DE) 2017-04-13 US disclosed
US-4838893-A AND TETRAAMINOPYRIDINES ASDEVELOPER COMPONENTS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1989-06-13 US disclosed
US-4661115-A Hair dyeing agents RUETGERSWERKE AKTIENGESELLSCHAFT (DE) 1987-04-28 US disclosed
US-4402699-A 2,4-DICHLORO-3-ALKYLIDINE-AMINOPHENOLS HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1983-09-06 US disclosed
US-4371370-A Oxidation hair dyes comprising bis-(2,4-diaminophenoxy)-alkanols as coupling components HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1983-02-01 US disclosed
US-4322212-A AS COUPLERS WITH CONVENTIONAL DEVELOPERS IN AQUEOUS SOLUTION HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1982-03-30 US disclosed
US-4226595-A Oxidation hair-coloring preparation based upon N,N-bis-(β-hydroxyethyl)-m-phenylenediamines HENKEL KOMMANDITGESELLSCHAFT AUF AKTIEN (DE) 1980-10-07 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (7 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-10080716-B2 Packaging unit having particular aminated silicone polymer KRT18, C9, AOC1 ALDH1A1 69/4885TDP1 3275/4885KDM4E 500/4885
US-20180221269-A1 LIGHTENING METHOD USING SPECIAL SILOXANE COMPOUNDS KRT18, KIT, DSC1 ALDH1A1 951/4885TDP1 2973/4885KDM4E 67/4885
US-10092502-B2 Oxidative hair lighteners with special aminated silicone polymers KRT18, ALDH7A1, MARK1 ALDH1A1 64/4885TDP1 3619/4885KDM4E 319/4885
US-10039707-B2 Oxidation dyeing agent having specific non-ionic silicone polymers KRT18, IK, MARK1 ALDH1A1 639/4885TDP1 3361/4885KDM4E 128/4885
US-10328016-B2 Dye composition with special non-ionic linear silicone polymers KRT18, MARK1, IK ALDH1A1 1262/4885TDP1 3698/4885KDM4E 533/4885
US-10835478-B2 Lightening method using special siloxane compounds KRT18, KIT, DSC1 ALDH1A1 951/4885TDP1 2973/4885KDM4E 67/4885
US-10117825-B2 Oxidation coloring composition with protein-siloxane polymers KRT18, CUTA, IK ALDH1A1 487/4885TDP1 4086/4885KDM4E 147/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.