SCHEMBL237185

SCHEMBL237185

C=CC(=O)OCc1ccccc1[SiH](OCC)OCC

nearest known ligand 0.39

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 5/20 0.39
THRA P10827 1/20 0.39
TSHR P16473 7/20 0.35
HPGD P15428 1/20 0.35
LMNA P02545 2/20 0.33
CYP4F2 P78329 2/20 0.33
CYP4A11 Q02928 2/20 0.33
MAPT P10636 1/20 0.33
MDM2 Q00987 1/20 0.33
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
HCAR2 Q8TDS4 1/20 0.32
GAA P10253 1/20 0.31
ALDH1A1 P00352 4/20 0.31
TP53 P04637 2/20 0.31
HIF1A Q16665 2/20 0.31
CYP3A4 P08684 1/20 0.31
HSD17B10 Q99714 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
SCHEMBL238275 0.90 THRB (0.41) THRBTHRATSHRHPGDLMNA
SCHEMBL235467 0.86 THRB (0.41) THRBTHRATSHRHPGDLMNA
SCHEMBL15361878 0.84 THRB (0.45) THRBTHRATSHRHPGDLMNA
SCHEMBL1716991 0.84 THRB (0.44) THRBTHRATSHRHPGDLMNA
SCHEMBL236262 0.81 THRB (0.37) THRBTSHRLMNACYP4F2CYP4A11
SCHEMBL1371361 0.79 THRB (0.47) THRBTHRATSHRHPGDLMNA
SCHEMBL29577996 0.78 THRB (0.53) THRBTHRATSHRHPGDLMNA
SCHEMBL10451653 0.78 THRB (0.53) THRBTHRATSHRHPGDLMNA
SCHEMBL2579936 0.77 THRB (0.50) THRBTHRAHPGDLMNAMAPT
SCHEMBL15361914 0.76 TSHR (0.48) THRBTHRATSHRHPGDLMNA

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