SCHEMBL5701477

SCHEMBL5701477

C=CC(=O)OCCCC(CO[SiH3])(O[Si](CC)(CC)CC)O[Si](CC)(CC)CC

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
TSHR P16473 7/20 0.46
HPGD P15428 1/20 0.46
ALDH1A1 P00352 4/20 0.42
CYP3A4 P08684 2/20 0.42
THRB P10828 1/20 0.40
TP53 P04637 3/20 0.36
HIF1A Q16665 3/20 0.36
HSD17B10 Q99714 1/20 0.36
MAPK1 P28482 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ATM Q13315 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
SCHEMBL5701925 0.88 TSHR (0.46) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL5702133 0.86 ATM (0.37) ATM
SCHEMBL5701744 0.84 TSHR (0.43) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL5701878 0.81 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL5701403 0.78 TSHR (0.45) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL5701481 0.78 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL1501333 0.76 THRB (0.56) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL8899035 0.76 TSHR (0.52) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL5702059 0.73 ATM (0.33) TSHRHPGDALDH1A1CYP3A4ATM
SCHEMBL5702090 0.73 ATM (0.37) ATM

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
EP-1510520-B1 Preparation of branched siloxane SHINETSU CHEMICAL CO (JP) 2006-07-26 EP disclosed
US-6943264-B2 Preparation of branched siloxane SHIN-ETSU CHEMICAL, CO., LTD. (JP) 2005-09-13 US disclosed
US-20050049427-A1 Preparation of branched siloxane SHIN-ETSU CHEMICAL CO., LTD. (JP) 2005-03-03 US disclosed
EP-1510520-A1 Preparation of branched siloxane Shin-Etsu Chemical Co., Ltd. (JP) 2005-03-02 EP disclosed