SCHEMBL15469253

SCHEMBL15469253

C=C(C)C(=O)CCCC[Si](C)(C)OC

nearest known ligand 0.31

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CES2 O00748 4/20 0.31
CES1 P23141 4/20 0.31
ALDH1A1 P00352 2/20 0.31
TSHR P16473 1/20 0.31
LMNA P02545 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
SCHEMBL7943777 0.94 TSHR (0.32) CES1ALDH1A1TSHR
SCHEMBL18419462 0.85 ALDH1A1 (0.35) CES2CES1ALDH1A1TSHR
SCHEMBL6261253 0.83 CES1 (0.32) CES2CES1ALDH1A1LMNA
SCHEMBL12759296 0.82
SCHEMBL8361178 0.81 CES2 (0.34) CES2CES1ALDH1A1TSHRLMNA
SCHEMBL31745691 0.81 CES2 (0.34) CES2CES1ALDH1A1TSHRLMNA
SCHEMBL12775038 0.81 CES1 (0.31) CES2CES1
SCHEMBL10030119 0.81 CES2 (0.31) CES2CES1
SCHEMBL465121 0.79 ALDH1A1 (0.37) CES1ALDH1A1TSHR
SCHEMBL18419461 0.79 CES1 (0.33) CES2CES1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20140046084-A1 Siloxane Compound and Cured Product Thereof CENTRAL GLASS COMPANY, LIMITED (JP) 2014-02-13 US disclosed
US-20140046084-A1 Siloxane Compound and Cured Product Thereof CENTRAL GLASS COMPANY, LIMITED (JP) 2014-02-13 US disclosed