SCHEMBL237882

SCHEMBL237882

C=CC(=O)OC[Si](OCCC)(c1ccccc1)c1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.46
TSHR P16473 8/20 0.41
HPGD P15428 1/20 0.41
LMNA P02545 1/20 0.40
ALDH1A1 P00352 6/20 0.37
THRA P10827 1/20 0.36
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 2/20 0.34
CYP3A4 P08684 1/20 0.34
GAA P10253 2/20 0.34
SMN1; SMN2 Q16637 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
L3MBTL1 Q9Y468 1/20 0.33
KDM4E B2RXH2 1/20 0.32
GLA P06280 1/20 0.32
CASP1 P29466 1/20 0.32
KPNA2 P52292 1/20 0.32
CASP7 P55210 1/20 0.32
CHRM2 P08172 1/20 0.32

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
SCHEMBL238593 0.89 THRB (0.44) THRBTSHRHPGDALDH1A1THRA
SCHEMBL238274 0.86 THRB (0.46) THRBTSHRHPGDLMNAALDH1A1
SCHEMBL237893 0.82 THRB (0.46) THRBTSHRHPGDALDH1A1THRA
SCHEMBL237430 0.81 TSHR (0.40) THRBTSHRLMNAALDH1A1TP53
SCHEMBL1066699 0.80 THRB (0.48) THRBTSHRHPGDLMNAALDH1A1
SCHEMBL1063249 0.77 TSHR (0.49) THRBTSHRHPGDLMNAALDH1A1
SCHEMBL237184 0.77 THRB (0.44) THRBTSHRHPGDALDH1A1THRA
SCHEMBL7873872 0.76 TSHR (0.48) THRBTSHRHPGDLMNAALDH1A1
SCHEMBL9411565 0.76 THRB (0.49) THRBTSHRHPGDLMNAALDH1A1
SCHEMBL1716988 0.76 THRB (0.49) THRBTSHRHPGDALDH1A1THRA

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
US-9745406-B2 Curable composition CEMEDINE CO., LTD. (JP) 2017-08-29 US disclosed
EP-2412756-B1 CURABLE COMPOSITION CEMEDINE CO LTD (JP) 2016-12-21 EP disclosed
EP-2412756-A1 CURABLE COMPOSITION CEMEDINE CO., LTD. (JP) 2012-02-01 EP disclosed
US-20120004371-A1 CURABLE COMPOSITION CEMEDINE CO., LTD. (JP) 2012-01-05 US disclosed