SCHEMBL15512931

SCHEMBL15512931

OCCOCCOCCOC1(O)CCC(O)C1O

nearest known ligand 0.38

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.38
KMT2A Q03164 2/20 0.38
TSHR P16473 2/20 0.34
MAPK1 P28482 1/20 0.34
THRB P10828 1/20 0.32
HTT P42858 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL3147884 0.71 MEN1 (0.41) MEN1KMT2ATSHRMAPK1THRB
Triethylene Glycol SCHEMBL15512930 0.66 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16548120 0.64 MEN1 (0.46) MEN1KMT2ATSHRMAPK1THRB
Di(Hydroxyethyl)Ether SCHEMBL4471347 0.63 TSHR (0.59) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL45160 0.62 MEN1 (1.00) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL4092706 0.62 MEN1 (1.00) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL12865309 0.62 MEN1 (1.00) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL19305255 0.62 MEN1 (1.00) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL3359595 0.62 MEN1 (1.00) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL19000749 0.62 MEN1 (1.00) MEN1KMT2ATSHRMAPK1THRB

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-1804045-B1 Method and Kit for treating a biological sample QIAGEN GMBH (DE) 2014-03-12 EP claimed