SCHEMBL237893

SCHEMBL237893

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

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
THRB P10828 4/20 0.46
TSHR P16473 7/20 0.36
HPGD P15428 1/20 0.35
ALDH1A1 P00352 3/20 0.34
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
CYP3A4 P08684 2/20 0.34
AKT1 P31749 1/20 0.34
HSD17B10 Q99714 1/20 0.34
KMT2A Q03164 1/20 0.34
MAPT P10636 1/20 0.34
THRA P10827 1/20 0.34
GSTO1 P78417 1/20 0.33

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 0.85 THRB (0.44) THRBTSHRHPGDALDH1A1TP53
SCHEMBL235466 0.84 THRB (0.46) THRBTSHRHPGDALDH1A1TP53
SCHEMBL237882 0.82 THRB (0.46) THRBTSHRHPGDALDH1A1TP53
SCHEMBL8672652 0.82 THRB (0.49) THRBTSHRHPGDALDH1A1TP53
SCHEMBL1716988 0.81 THRB (0.49) THRBTSHRHPGDALDH1A1TP53
SCHEMBL9411565 0.81 THRB (0.49) THRBTSHRHPGDALDH1A1TP53
SCHEMBL24278421 0.80 THRB (0.51) THRBTSHRHPGDALDH1A1TP53
SCHEMBL238397 0.78 ELANE (0.39) THRBTSHRHPGDALDH1A1KMT2A
SCHEMBL15807762 0.78 THRB (0.49) THRBTSHRHPGDALDH1A1TP53
SCHEMBL9246668 0.76 THRB (0.44) THRBTSHRHPGDALDH1A1TP53

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