SCHEMBL27720505

SCHEMBL27720505

C=CC(=O)OC(OC(=O)C=C)C(O)CC

nearest known ligand 0.41

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.41
HPGD P15428 1/20 0.39
ALDH1A1 P00352 5/20 0.34
TP53 P04637 3/20 0.34
HIF1A Q16665 3/20 0.34
CYP3A4 P08684 2/20 0.34
HSD17B10 Q99714 1/20 0.34
THRB P10828 3/20 0.33
MAPK1 P28482 1/20 0.31
SMN1; SMN2 Q16637 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
SCHEMBL27616488 0.92 TSHR (0.38) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL22444375 0.88 TSHR (0.33) TSHRHPGDALDH1A1THRB
SCHEMBL27465013 0.87 TSHR (0.35) TSHRHPGD
SCHEMBL28620103 0.83 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2424095 0.82 TSHR (0.44) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL11193107 0.78
SCHEMBL26116 0.78
SCHEMBL28524913 0.77 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
Hydrogen Peroxide SCHEMBL28304847 0.77 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A
Ammonia Solution, Strong SCHEMBL28302964 0.77 TSHR (0.42) TSHRHPGDALDH1A1TP53HIF1A

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105814092-B Composition for hydrophilic cured product 三井化学株式会社 2018-09-21 CN disclosed
CN-107430213-A Hydrophilic optical feature monofilm and its layered product 三井化学株式会社 2017-12-01 CN disclosed
CN-103703036-B Monolayer film and hydrophilic material comprising same 三井化学株式会社 2017-05-03 CN disclosed
CN-104830006-A STIMULUS-RESPONSIVE GEL MATERIAL SEIKO EPSON CORP 2015-08-12 CN disclosed
CN-104830005-A STIMULUS-RESPONSIVE GEL MATERIAL AND METHOD FOR PRODUCING STIMULUS-RESPONSIVE GEL MATERIAL SEIKO EPSON CORP 2015-08-12 CN disclosed
CN-104823264-A Imprint method and curable composition for imprint CANON KK 2015-08-05 CN disclosed
CN-103025766-B Single-layer film and hydrophilic material comprising same MITSUI CHEMICALS INC 2014-11-05 CN disclosed
CN-103703036-A Monolayer film and hydrophilic material comprising same MITSU CHEMICALS INC 2014-04-02 CN disclosed
CN-101952381-B Primer composition MITSUI CHEMICALS INC 2013-08-14 CN disclosed
CN-103025766-A Single-layer film and hydrophilic material comprising same MITSUI CHEMICALS INC 2013-04-03 CN disclosed
CN-101309760-B Single-layer film and hydrophilic material comprising same MITSU CHEMICALS INC 2012-07-25 CN disclosed
CN-101952381-A Primer composition MITSUI CHEMICALS INC 2011-01-19 CN disclosed
CN-101309760-A Single-layer film and hydrophilic material comprising same MITSUI CHEMICALS INC (JP) 2008-11-19 CN disclosed