SCHEMBL3147884

SCHEMBL3147884

OCCOCCOC1(O)CCC(O)CC1

nearest known ligand 0.41

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 2/20 0.41
KMT2A Q03164 2/20 0.41
TSHR P16473 2/20 0.37
MAPK1 P28482 1/20 0.37
THRB P10828 1/20 0.34
HTT P42858 1/20 0.34
MAPT P10636 1/20 0.34

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
SCHEMBL28396629 0.88
Di(Hydroxyethyl)Ether SCHEMBL4471347 0.75 TSHR (0.59) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL15512931 0.71 MEN1 (0.38) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL7184452 0.70 SHBG (0.32)
Cyclohexanol SCHEMBL28181747 0.69 TSHR (0.50) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL16548121 0.69 DRD3 (0.30)
SCHEMBL5516435 0.66
Triethylene Glycol SCHEMBL15512930 0.65 MEN1 (0.55) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL4092706 0.64 MEN1 (1.00) MEN1KMT2ATSHRMAPK1THRB
SCHEMBL5135405 0.64 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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1770132-B1 Inkjet ink composition FUJIFILM CORP (JP) 2010-07-21 EP disclosed
US-7723400-B2 Inkjet ink composition FUJIFILM CORPORATION (JP) 2010-05-25 US disclosed
US-20070078195-A1 Inkjet ink composition FUJI PHOTO FILM CO., LTD. 2007-04-05 US disclosed
EP-1770132-A1 Inkjet ink composition FUJIFILM Corporation (JP) 2007-04-04 EP disclosed