SCHEMBL5178169

SCHEMBL5178169

CCCCCCCCCCCCCC(=O)OCCN(CCCN1CCC(CCN)CC1)CCOC(=O)CCCCCCCCCCCCC

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DNM1 Q05193 1/20 0.45
DGKA P23743 1/20 0.42
GNAO1 P09471 5/20 0.40
GNAI3 P08754 4/20 0.40
GNAI1 P63096 4/20 0.40
HTR4 Q13639 5/20 0.39
ACHE P22303 3/20 0.38
CHRM1 P11229 3/20 0.37
HRH1 P35367 2/20 0.37
HRH2 P25021 1/20 0.37
CHRM2 P08172 1/20 0.37
CHRM4 P08173 1/20 0.37
HTR1A P08908 1/20 0.37
CHRM5 P08912 1/20 0.37
ADRA2A P08913 1/20 0.37
DRD2 P14416 1/20 0.37
ADRA2B P18089 1/20 0.37
CHRM3 P20309 1/20 0.37
DRD4 P21917 1/20 0.37
ADRA1D P25100 1/20 0.37

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
SCHEMBL5179258 1.00 DNM1 (0.45) DNM1DGKAGNAO1GNAI3GNAI1
SCHEMBL5179404 0.91 DNM1 (0.47) DNM1DGKAGNAO1GNAI3GNAI1
SCHEMBL5188960 0.87 DNM1 (0.47) DNM1DGKAGNAO1GNAI3GNAI1
SCHEMBL5179274 0.87 DNM1 (0.47) DNM1DGKAGNAO1GNAI3GNAI1
SCHEMBL5178032 0.87 GNAI3 (0.51) DNM1DGKAGNAO1GNAI3GNAI1
SCHEMBL5178119 0.87 GNAI3 (0.51) DNM1DGKAGNAO1GNAI3GNAI1
SCHEMBL5179463 0.86 DNM1 (0.46) DNM1DGKAGNAO1GNAI3GNAI1
SCHEMBL5180334 0.86 DNM1 (0.48) DNM1DGKAGNAO1GNAI3GNAI1
SCHEMBL5177904 0.86 DNM1 (0.48) DNM1DGKAGNAO1GNAI3GNAI1
SCHEMBL5179746 0.85 DNM1 (0.40) DNM1DGKAGNAO1GNAI3GNAI1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0927174-B1 NEW AMINO ALCOHOL DERIVATIVES, PROCESS FOR THE PRODUCTION THEREOF AND MEDICAMENTS AND REAGENTS CONTAINING THESE COMPOUNDS MEDIGENE AG (DE) 2007-12-12 EP disclosed