SCHEMBL3913243

SCHEMBL3913243

C=CC(=O)OCCC[SiH2]C(Oc1ccccc1)Oc1ccccc1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
THRB P10828 2/20 0.55
TSHR P16473 6/20 0.44
ALDH1A1 P00352 3/20 0.44
CYP3A4 P08684 1/20 0.44
HPGD P15428 1/20 0.41
TP53 P04637 2/20 0.37
HIF1A Q16665 2/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 2/20 0.34
AKR1B10 O60218 2/20 0.33
AKR1B1 P15121 2/20 0.33
GAA P10253 1/20 0.33
KDM4E B2RXH2 1/20 0.33
MEN1 O00255 1/20 0.33
KMT2A Q03164 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
HCAR2 Q8TDS4 1/20 0.33
MTNR1A P48039 1/20 0.32
MTNR1B P49286 1/20 0.32
TGM2 P21980 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
SCHEMBL3917305 0.83 THRB (0.53) THRBTSHRALDH1A1CYP3A4TP53
SCHEMBL4661265 0.81 THRB (0.50) THRBTSHRALDH1A1CYP3A4HPGD
SCHEMBL28846555 0.79 THRB (0.59) THRBTSHRALDH1A1CYP3A4HPGD
SCHEMBL1031149 0.76 THRB (0.84) THRBTSHRALDH1A1CYP3A4HPGD
SCHEMBL69211 0.76 THRB (0.84) THRBTSHRALDH1A1CYP3A4HPGD
SCHEMBL705385 0.75 KCNA3 (0.39) TSHRALDH1A1MTNR1AMTNR1B
SCHEMBL704372 0.75 KCNA3 (0.39) TSHRALDH1A1MTNR1AMTNR1B
SCHEMBL16893675 0.75 THRB (0.81) THRBTSHRALDH1A1CYP3A4HPGD
SCHEMBL16893811 0.75 THRB (0.81) THRBTSHRALDH1A1CYP3A4HPGD
SCHEMBL8040124 0.75 THRB (0.81) THRBTSHRALDH1A1CYP3A4HPGD

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 6 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7619108-B2 Process for preparing unsaturated organosilicon compounds WACKER CHEMIE AG (DE) 2009-11-17 US disclosed
EP-1954701-B1 PROCESS FOR PREPARING UNSATURATED ORGANOSILICON COMPOUNDS WACKER CHEMIE AG (DE) 2009-03-18 EP disclosed
US-20080293958-A1 Process for Preparing Unsaturated Organosilicon Compounds WACKER CHEMIE AG (DE) 2008-11-27 US disclosed
US-6815554-B2 REACTING A HALOALKYLSILANE WITH A SALT OF AN UNSATURATED CARBOXYLIC ACID IN THE PRESENCE OF A PHASE TRANSFER CATALYST; BONDING AGENTS WACKER-CHEMIE GMBH (DE) 2004-11-09 US disclosed
US-20020151736-A1 PROCESS FOR PREPARING UNSATURATED ORGANOSILICON COMPOUNDS WACKER-CHEMIE GMBH (DE) 2002-10-17 US disclosed
EP-1249454-A1 Preparation of unsaturated organo-silicon compounds Wacker-Chemie GmbH (DE) 2002-10-16 EP disclosed