N,N-Dimethylethanaminium

N,N-Dimethylethanaminium

SCHEMBL446054

CCCC=C(C)C(N)=O.CCN(C)C

nearest known ligand 0.33

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GRIK1 P39086 1/20 0.33
GRIK2 Q13002 1/20 0.33
FAAH O00519 2/20 0.31
BACE1 P56817 1/20 0.31

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
N,N-Dimethylethanaminium SCHEMBL3034891 1.00 GRIK1 (0.33) GRIK1GRIK2FAAHBACE1
Trimethylammonium SCHEMBL3040292 0.92 GRIK1 (0.35) GRIK1GRIK2FAAHBACE1
Trimethylammonium SCHEMBL446487 0.92 GRIK1 (0.35) GRIK1GRIK2FAAHBACE1
Trimethylammonium SCHEMBL22999943 0.90 GRIK1 (0.34) GRIK1GRIK2FAAHBACE1
Trimethylammonium SCHEMBL828743 0.90 GRIK1 (0.34) GRIK1GRIK2FAAHBACE1
SCHEMBL554467 0.89
SCHEMBL554468 0.89
Trimethylammonium SCHEMBL28199924 0.88 GRIK1 (0.33) GRIK1GRIK2FAAHBACE1
SCHEMBL9619012 0.88 GRIK1 (0.33) GRIK1GRIK2FAAHBACE1
Methylamine SCHEMBL4365894 0.87 GRIK1 (0.37) GRIK1GRIK2FAAHBACE1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1825884-B1 Brightening and/or colouring agent with reduced potential for irritation HENKEL AG & CO KGAA (DE) 2017-08-16 EP claimed
EP-1813260-B1 Bleaching and/or colouring agent with reduced potential for irritation HENKEL AG & CO KGAA (DE) 2017-05-31 EP claimed
US-20160199282-A1 PERFORMANCE-ENHANCED HAIR TREATMENT COMPOSITION HENKEL AG & CO. KGAA (DE) 2016-07-14 US disclosed
US-20140271520-A1 NON-WEIGHING HAIR PREPARATIONS HENKEL AG & CO., KGAA (DE) 2014-09-18 US disclosed
US-8802068-B2 Non-weighing hair preparations HENKEL AG & CO. KGAA (DE) 2014-08-12 US disclosed
US-20120251473-A1 NON-WEIGHING HAIR PREPARATIONS HENKEL AG & CO. KGAA (DE) 2012-10-04 US disclosed
US-20120201773-A1 UNENCUMBERING HAIR TREATMENT PRODUCT HENKEL AG & CO. KGAA (DE) 2012-08-09 US disclosed
US-20120060856-A1 Cosmetic Composition and Reshaping Method for Keratinic Fibers HENKEL AG & CO. KGAA (DE) 2012-03-15 US disclosed
US-20100215604-A1 Cosmetic Compositions with Chitosan and Silicone Elastomers HENKEL AG & CO. KGAA (DE) 2010-08-26 US disclosed
US-20090304620-A1 HAIR TREATMENT PRODUCTS COMPRISING POLYMERS HENKEL AG & CO. KGAA (DE) 2009-12-10 US disclosed
US-20040107506-A1 Polysiloxane-containing polymers for wrinkleproofing cellulosic textiles BASF AKTIENGESELLSCHAFT (DE) 2004-06-10 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-20090304620-A1 HAIR TREATMENT PRODUCTS COMPRISING POLYMERS ASS1, SRM, COL1A1 GRIK1 1817/4885GRIK2 1894/4885FAAH 2265/4885
US-20100215604-A1 Cosmetic Compositions with Chitosan and Silicone Elastomers HDAC10, HDAC1, HDAC3 GRIK1 2511/4885GRIK2 2509/4885FAAH 1371/4885
US-20120201773-A1 UNENCUMBERING HAIR TREATMENT PRODUCT POLR1C, SPTAN1, SMURF1 GRIK1 2385/4885GRIK2 3126/4885FAAH 2245/4885
US-20120251473-A1 NON-WEIGHING HAIR PREPARATIONS KRT18, KRTCAP2, PSMB10 GRIK1 2837/4885GRIK2 3138/4885FAAH 1093/4885
US-20120060856-A1 Cosmetic Composition and Reshaping Method for Keratinic Fibers H1-0, H1-3, H1-2 GRIK1 3553/4885GRIK2 2931/4885FAAH 1016/4885
US-20160199282-A1 PERFORMANCE-ENHANCED HAIR TREATMENT COMPOSITION KRT18, YWHAZ, PHYKPL GRIK1 416/4885GRIK2 485/4885FAAH 833/4885
US-20140271520-A1 NON-WEIGHING HAIR PREPARATIONS KRT18, KRTCAP2, PSMB10 GRIK1 2837/4885GRIK2 3138/4885FAAH 1093/4885

“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.