N,N-Dimethylethanaminium

N,N-Dimethylethanaminium

SCHEMBL446716

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

nearest known ligand 0.38

Full drug profile on Sugi Atlas →

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.38
EGFR P00533 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
Trimethylammonium SCHEMBL156969 0.90 TDP1 (0.41) TDP1
Trimethylammonium SCHEMBL28049118 0.88 TDP1 (0.39) TDP1
Trimethylammonium SCHEMBL1232763 0.88 TDP1 (0.39) TDP1EGFR
Trimethylammonium SCHEMBL3296337 0.88 TDP1 (0.39) TDP1
SCHEMBL472559 0.87
Water SCHEMBL27545151 0.85
Hydrochloric Acid SCHEMBL27701510 0.85
SCHEMBL30779720 0.85
Methylamine SCHEMBL9100821 0.85
SCHEMBL28796438 0.85

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 13 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
EP-2432446-A2 COSMETIC COMPOSITION AND RESHAPING METHOD FOR KERATINIC FIBERS Henkel AG & Co. KGaA (DE) 2012-03-28 EP disclosed
US-20120060856-A1 Cosmetic Composition and Reshaping Method for Keratinic Fibers HENKEL AG & CO. KGAA (DE) 2012-03-15 US disclosed
WO-2010133382-A2 COSMETIC COMPOSITION AND RESHAPING METHOD FOR KERATINIC FIBERS HENKEL AG & CO. KGAA (DE) 2010-11-25 WO 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
CN-101394830-A Cosmetic agents comprising purine and/or purine derivatives I HENKEL KGAA (DE) 2009-03-25 CN 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 TDP1 3165/4885EGFR 177/4885
US-20100215604-A1 Cosmetic Compositions with Chitosan and Silicone Elastomers HDAC10, HDAC1, HDAC3 TDP1 3339/4885EGFR 621/4885
US-20120201773-A1 UNENCUMBERING HAIR TREATMENT PRODUCT POLR1C, SPTAN1, SMURF1 TDP1 4173/4885EGFR 203/4885
US-20120251473-A1 NON-WEIGHING HAIR PREPARATIONS KRT18, KRTCAP2, PSMB10 TDP1 3411/4885EGFR 938/4885
US-20120060856-A1 Cosmetic Composition and Reshaping Method for Keratinic Fibers H1-0, H1-3, H1-2 TDP1 2649/4885EGFR 2683/4885
US-20160199282-A1 PERFORMANCE-ENHANCED HAIR TREATMENT COMPOSITION KRT18, YWHAZ, PHYKPL TDP1 3582/4885EGFR 58/4885
US-20140271520-A1 NON-WEIGHING HAIR PREPARATIONS KRT18, KRTCAP2, PSMB10 TDP1 3411/4885EGFR 938/4885

“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.