SCHEMBL7953289

SCHEMBL7953289

CCN(CC)CCOCCO.NCCOCCO

nearest known ligand 0.42

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.42
KMT2A Q03164 3/20 0.42
POLB P06746 1/20 0.42
TSHR P16473 4/20 0.40
MAPK1 P28482 1/20 0.40
ALDH1A1 P00352 2/20 0.39
THRB P10828 2/20 0.36
HTT P42858 2/20 0.36
MAPT P10636 1/20 0.36
KDM4E B2RXH2 3/20 0.35
CYP2D6 P10635 2/20 0.33
MAOA P21397 1/20 0.33
HTR3A P46098 1/20 0.33
HRH3 Q9Y5N1 1/20 0.33
BLM P54132 2/20 0.33
CHRM2 P08172 2/20 0.33
CHRM1 P11229 2/20 0.33
DRD3 P35462 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
NPSR1 Q6W5P4 1/20 0.33

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
SCHEMBL749806 0.89 MEN1 (0.50) MEN1KMT2APOLBTSHRMAPK1
SCHEMBL5933721 0.89 MEN1 (0.50) MEN1KMT2APOLBTSHRALDH1A1
SCHEMBL25529334 0.87 MEN1 (0.48) MEN1KMT2APOLBTSHRALDH1A1
SCHEMBL7755866 0.87 MEN1 (0.52) MEN1KMT2APOLBTSHRMAPK1
Ammonia Solution, Strong SCHEMBL4366934 0.87 MEN1 (0.48) MEN1KMT2APOLBTSHRMAPK1
SCHEMBL18357952 0.87 MEN1 (0.52) MEN1KMT2APOLBTSHRMAPK1
SCHEMBL11045236 0.85 TSHR (0.50) MEN1KMT2APOLBTSHRMAPK1
SCHEMBL12970038 0.83 MEN1 (0.52) MEN1KMT2APOLBTSHRMAPK1
SCHEMBL15965444 0.83 MEN1 (0.52) MEN1KMT2APOLBTSHRMAPK1
SCHEMBL11387775 0.81 TSHR (0.46) MEN1KMT2APOLBTSHRMAPK1

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-1102787-A1 2'-O-AMINOETHYLOXYETHYL-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 2001-05-30 EP disclosed
WO-2000008044-A1 2'-O-AMINOETHYLOXYETHYL-MODIFIED OLIGONUCLEOTIDES ISIS PHARMACEUTICALS, INC. (US) 2000-02-17 WO disclosed