SCHEMBL1036154

SCHEMBL1036154

C=C(C)C(=O)OCCC[Si](OC)(OC)OC.C=CC(=O)OCCC[Si](OC)(OC)OC.CCCCCCCCCCCCCCCCCC[Si](OC)(OC)OC

nearest known ligand 0.56

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
TSHR P16473 9/20 0.56
HPGD P15428 1/20 0.51
ALDH1A1 P00352 3/20 0.44
CYP3A4 P08684 1/20 0.44
HCAR2 Q8TDS4 3/20 0.38
THRB P10828 2/20 0.37
ATM Q13315 1/20 0.36
LMNA P02545 1/20 0.35
POLB P06746 1/20 0.34
APEX1 P27695 1/20 0.34
HTT P42858 1/20 0.34
TDP1 Q9NUW8 1/20 0.34
TP53 P04637 2/20 0.34
HIF1A Q16665 2/20 0.34
HSD17B10 Q99714 1/20 0.34
ZDHHC20 Q5W0Z9 1/20 0.33
ZDHHC2 Q9UIJ5 1/20 0.33
NAAA Q02083 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
SCHEMBL5971626 0.95 TSHR (0.58) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL5448469 0.92 TSHR (0.47) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL8068594 0.91 TSHR (0.54) TSHRHPGDALDH1A1CYP3A4HCAR2
Methacrylic Acid SCHEMBL27531007 0.88 TSHR (0.50) TSHRHPGDALDH1A1CYP3A4HCAR2
Acrylic Acid SCHEMBL27810281 0.88 TSHR (0.50) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL5080728 0.88 TSHR (0.44) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL424597 0.88 TSHR (0.44) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL6654168 0.88 TSHR (0.41) TSHRHPGDALDH1A1CYP3A4THRB
SCHEMBL27810283 0.87 TSHR (0.49) TSHRHPGDALDH1A1CYP3A4HCAR2
SCHEMBL28246671 0.87 TSHR (0.43) TSHRHPGDALDH1A1CYP3A4THRB

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
EP-2276836-A1 SURFACES WITH IMMOBILIZED ENZYMES OR ANTI-ICING PROTEINS Airbus Operations Limited (GB) 2011-01-26 EP disclosed
WO-2009136186-A1 SURFACES WITH IMMOBILIZED ENZYMES OR ANTI-ICING PROTEINS AIRBUS UK LIMITED (GB) 2009-11-12 WO disclosed