SCHEMBL5406669

SCHEMBL5406669

C=CC(=O)OC[SiH2]OC(=O)C(C)C

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
TSHR P16473 8/20 0.50
HPGD P15428 1/20 0.40
ALDH1A1 P00352 4/20 0.39
TP53 P04637 3/20 0.39
HIF1A Q16665 3/20 0.39
CYP3A4 P08684 2/20 0.39
HSD17B10 Q99714 1/20 0.39
MAPK1 P28482 1/20 0.36
SMN1; SMN2 Q16637 1/20 0.36
THRB P10828 2/20 0.34

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
SCHEMBL28035286 0.82 TSHR (0.46) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL7511201 0.80 TSHR (0.52) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL230818 0.79 TSHR (0.52) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL5069827 0.76 TSHR (0.40) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL28039850 0.76
SCHEMBL523854 0.76 ALDH1A1 (0.37) TSHRALDH1A1HSD17B10SMN1; SMN2
SCHEMBL545211 0.75 TSHR (0.36) TSHR
SCHEMBL5401382 0.74 TSHR (0.50) TSHRALDH1A1THRB
SCHEMBL13750180 0.73 TSHR (0.47) TSHRHPGDALDH1A1TP53HIF1A
SCHEMBL2608181 0.72 TSHR (0.61) 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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7276615-B2 Organofunctional surface-modified metal oxides WACKER CHEMIE AG (DE) 2007-10-02 US disclosed
EP-1473296-B1 Organofunctional surface modified metal oxides WACKER CHEMIE AG (DE) 2006-08-02 EP disclosed
US-20040220419-A1 Organofunctional surface-modified metal oxides WACKER-CHEMIE GMBH (DE) 2004-11-04 US disclosed
EP-1473296-A1 Organofunctional surface modified metal oxides Wacker-Chemie GmbH (DE) 2004-11-03 EP disclosed
US-5348986-A Polysiloxanes capped with mixture of curable groups, gels, acrylated polymers LOCTITE CORPORATION (US) 1994-09-20 US disclosed