SCHEMBL15903153

SCHEMBL15903153

CCCCC(CC)C(OCCOCCO)C(CC)CO

nearest known ligand 0.44

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.44
KMT2A Q03164 3/20 0.44
THRB P10828 1/20 0.44
HTT P42858 1/20 0.44
MAPT P10636 1/20 0.44
TSHR P16473 2/20 0.44
ALDH1A1 P00352 3/20 0.35
LMNA P02545 2/20 0.34
MAPK1 P28482 2/20 0.33
USP2 O75604 2/20 0.33
CYP3A4 P08684 1/20 0.33
CASP1 P29466 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
SLCO1B3 Q9NPD5 1/20 0.33
SLCO1B1 Q9Y6L6 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
SCHEMBL31215136 0.81 MEN1 (0.47) MEN1KMT2ATHRBHTTMAPT
Di(Hydroxyethyl)Ether SCHEMBL15903151 0.79 TSHR (0.48) MEN1KMT2ATHRBHTTMAPT
SCHEMBL11507467 0.76 MEN1 (0.42) MEN1KMT2ATHRBHTTMAPT
SCHEMBL25363941 0.75 TSHR (0.52) MEN1KMT2ATHRBHTTMAPT
SCHEMBL31601754 0.75 TSHR (0.52) MEN1KMT2ATHRBHTTMAPT
SCHEMBL3362082 0.75 TSHR (0.52) MEN1KMT2ATHRBHTTMAPT
SCHEMBL13760324 0.75 TSHR (0.52) MEN1KMT2ATHRBHTTMAPT
SCHEMBL29520872 0.74 TSHR (0.56) MEN1KMT2ATHRBHTTMAPT
SCHEMBL29521513 0.74 TSHR (0.56) MEN1KMT2ATHRBHTTMAPT
Triethylene Glycol SCHEMBL25299251 0.73 TSHR (0.54) MEN1KMT2ATHRBHTTMAPT

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-2948459-A1 NEW RADIATION-CURABLE COMPOUNDS AND COATING COMPOSITIONS BASF SE (DE) 2015-12-02 EP disclosed
WO-2014114534-A1 NEW RADIATION-CURABLE COMPOUNDS AND COATING COMPOSITIONS BASF SE (DE) 2014-07-31 WO disclosed