N,N-Dimethylethanaminium

N,N-Dimethylethanaminium

SCHEMBL2146563

CC(C)NC(C)C.CCN(C)C

nearest known ligand 0.53

Full drug profile on Sugi Atlas →

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 1/20 0.53

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
SCHEMBL1429706 0.80 TDP1 (0.53) TDP1
Trimethylammonium SCHEMBL28854292 0.78 TDP1 (0.73) TDP1
SCHEMBL27798996 0.78 TDP1 (0.50) TDP1
SCHEMBL571875 0.75 TDP1 (0.47) TDP1
SCHEMBL28021736 0.74 TDP1 (0.67) TDP1
N,N-Dimethylethanaminium SCHEMBL2146567 0.73 TSHR (0.36) TDP1
N,N-Dimethylethanaminium SCHEMBL16338 0.73
N,N-Dimethylethanaminium SCHEMBL352062 0.73
SCHEMBL2020 0.73
SCHEMBL27928984 0.73 TDP1 (1.00) TDP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2523902-A1 PROCESS FOR THE PREPARATION OF CARBON NANOTUBES HAVING HYDROXYALKYL ESTER GROUPS, AND MATERIALS AND DISPERSIONS CONTAINING THESE CARBON NANOTUBES Bayer Intellectual Property GmbH (DE) 2012-11-21 EP disclosed
WO-2011086049-A1 PROCESS FOR THE PREPARATION OF CARBON NANOTUBES HAVING HYDROXYALKYL ESTER GROUPS, AND MATERIALS AND DISPERSIONS CONTAINING THESE CARBON NANOTUBES BAYER MATERIALSCIENCE AG (DE) 2011-07-21 WO disclosed