SCHEMBL3132573

SCHEMBL3132573

C=C(C)C(=O)OCCO[Si](CCC)(OCC)c1ccccc1

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.43
TSHR P16473 2/20 0.39
POLB P06746 1/20 0.37
APEX1 P27695 1/20 0.37
HTT P42858 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
MAPT P10636 2/20 0.36
ALDH1A1 P00352 2/20 0.36
ELANE P08246 1/20 0.35
SMN1; SMN2 Q16637 3/20 0.34
GAA P10253 1/20 0.34
LMNA P02545 3/20 0.33
CA1 P00915 2/20 0.32
CA2 P00918 2/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
NPC1 O15118 2/20 0.31
RAB9A P51151 2/20 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
SCHEMBL27775044 0.90 THRB (0.45) THRBTSHRPOLBAPEX1HTT
SCHEMBL27863692 0.90 THRB (0.44) THRBTSHRPOLBAPEX1HTT
SCHEMBL27849592 0.88 THRB (0.43) THRBTSHRPOLBAPEX1HTT
SCHEMBL2345676 0.87 TSHR (0.44) THRBTSHRPOLBAPEX1HTT
SCHEMBL7527455 0.86 TSHR (0.47) THRBTSHRPOLBAPEX1HTT
SCHEMBL21066753 0.85 TSHR (0.49) THRBTSHRPOLBAPEX1HTT
SCHEMBL21066797 0.85 TSHR (0.49) THRBTSHRPOLBAPEX1HTT
SCHEMBL4859732 0.84 TSHR (0.47) THRBTSHRPOLBAPEX1HTT
SCHEMBL9402704 0.82 TSHR (0.49) THRBTSHRPOLBAPEX1HTT
SCHEMBL7532392 0.82 TSHR (0.49) THRBTSHRPOLBAPEX1HTT

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2010053629-A1 ASYMMETRIC PHOTO-PATTERNABLE SOL-GEL PRECURSORS AND THEIR METHODS OF PREPARATION NITTO DENKO CORPORATION (JP) 2010-05-14 WO disclosed