SCHEMBL238286

SCHEMBL238286

C=C(C)C(=O)OCc1ccccc1[SiH](OCCC)OCCC

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.39
TDP1 Q9NUW8 3/20 0.36
POLB P06746 1/20 0.36
APEX1 P27695 1/20 0.36
HTT P42858 1/20 0.36
ALDH1A1 P00352 7/20 0.36
THRB P10828 1/20 0.36
GAA P10253 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
LMNA P02545 2/20 0.36
MAPT P10636 1/20 0.33
ELANE P08246 1/20 0.32
ESR1 P03372 1/20 0.32
CHRM1 P11229 1/20 0.32
SLC6A2 P23975 1/20 0.32
KDR P35968 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.32
TP53 P04637 1/20 0.31
CYP3A4 P08684 1/20 0.31
MAPK1 P28482 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
SCHEMBL236262 0.90 THRB (0.37) TSHRTDP1POLBAPEX1HTT
SCHEMBL15361896 0.86 TSHR (0.46) TSHRTDP1POLBAPEX1HTT
SCHEMBL237532 0.85 POLB (0.36) TSHRTDP1POLBAPEX1HTT
SCHEMBL840794 0.81 POLB (0.38) TSHRTDP1POLBAPEX1HTT
SCHEMBL238275 0.81 THRB (0.41) TSHRTDP1ALDH1A1THRBGAA
SCHEMBL4202389 0.79 TSHR (0.44) TSHRTDP1POLBAPEX1HTT
SCHEMBL29577269 0.79 TSHR (0.44) TSHRTDP1POLBAPEX1HTT
SCHEMBL2345681 0.78 THRB (0.43) TSHRTDP1POLBAPEX1HTT
SCHEMBL8144936 0.78 ALDH1A1 (0.32) ALDH1A1SMN1; SMN2
SCHEMBL1372181 0.78 THRB (0.42) TSHRTDP1POLBAPEX1HTT

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