SCHEMBL27714728

SCHEMBL27714728

C=C(C)C(=O)O[C](OC)C(OC)OC

nearest known ligand 0.50

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 2/20 0.50
TSHR P16473 1/20 0.36
HSD17B10 Q99714 1/20 0.31
TDP1 Q9NUW8 1/20 0.31
THRB P10828 1/20 0.31

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
SCHEMBL7080384 0.75 ALDH1A1 (0.62) ALDH1A1TSHRHSD17B10TDP1THRB
SCHEMBL1890862 0.74 ALDH1A1 (0.42) ALDH1A1TSHRHSD17B10TDP1THRB
SCHEMBL28267755 0.73 ALDH1A1 (0.59) ALDH1A1TSHRHSD17B10TDP1THRB
SCHEMBL16442916 0.72 ALDH1A1 (0.83) ALDH1A1TSHRHSD17B10TDP1THRB
SCHEMBL28170047 0.71 ALDH1A1 (0.61) ALDH1A1TSHRHSD17B10TDP1THRB
SCHEMBL15963 0.71 ALDH1A1 (0.61) ALDH1A1TSHRHSD17B10TDP1THRB
SCHEMBL10636466 0.69
SCHEMBL1849 0.69
SCHEMBL8953021 0.69 ALDH1A1 (0.58) ALDH1A1TSHRHSD17B10TDP1THRB
Hydrochloric Acid SCHEMBL17099626 0.69 ALDH1A1 (0.58) ALDH1A1TSHRHSD17B10TDP1THRB

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
CN-101094888-B Reactive Silicic Acid Suspension WACKER CHEMIE AG 2011-05-04 CN disclosed
CN-101233182-B Stable fumed silica suspensions for reinforcing reactive resins WACKER CHEMICAL AG 2011-02-16 CN disclosed
CN-101233182-A Stable HDK suspensions for reinforcing reactive resins WACKER CHEMIE AG (DE) 2008-07-30 CN disclosed
CN-101094888-A Reactive Silicic Acid Suspension WACKER CHEMIE AG (DE) 2007-12-26 CN disclosed