SCHEMBL1079368

SCHEMBL1079368

[CH2]C(CO)OCCOCC

nearest known ligand 0.44

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.44
TSHR P16473 1/20 0.37
THRB P10828 1/20 0.36

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
SCHEMBL28799965 0.81 ALDH1A1 (0.36) ALDH1A1TSHRTHRB
SCHEMBL7631830 0.79 ALDH1A1 (0.35) ALDH1A1TSHRTHRB
SCHEMBL14921241 0.79 ALDH1A1 (0.35) ALDH1A1TSHRTHRB
SCHEMBL10523283 0.78
SCHEMBL6436203 0.78
SCHEMBL27883002 0.77 ALDH1A1 (0.33) ALDH1A1TSHRTHRB
SCHEMBL27297448 0.76
SCHEMBL1115824 0.76 ALDH1A1 (0.48) ALDH1A1TSHRTHRB
SCHEMBL9322932 0.75 ALDH1A1 (0.39) ALDH1A1TSHRTHRB
SCHEMBL211364 0.75 ALDH1A1 (0.41) ALDH1A1TSHRTHRB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20120225306-A1 BRAZING PROCESS CERAMIC FUEL CELLS LIMITED (AU) 2012-09-06 US disclosed
EP-2451605-A1 A BRAZING PROCESS Ceramic Fuel Cells Limited (AU) 2012-05-16 EP disclosed
WO-2011003154-A1 A BRAZING PROCESS CERAMIC FUEL CELLS LIMITED (AU) 2011-01-13 WO disclosed