SCHEMBL28012385

SCHEMBL28012385

C=C(C)C(=O)OCCO[SiH](c1ccccc1)c1ccccc1

nearest known ligand 0.48

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.48
POLB P06746 1/20 0.48
APEX1 P27695 1/20 0.48
HTT P42858 1/20 0.48
THRB P10828 2/20 0.46
TSHR P16473 4/20 0.41
ELANE P08246 1/20 0.40
ALDH1A1 P00352 5/20 0.37
MAPT P10636 1/20 0.37
CA1 P00915 2/20 0.37
CA2 P00918 2/20 0.37
GAA P10253 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.35
LMNA P02545 1/20 0.34
KDM4E B2RXH2 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
Benzene SCHEMBL28145673 0.80 THRB (0.65) TDP1POLBAPEX1HTTTHRB
Toluene SCHEMBL28087905 0.80 THRB (0.52) TDP1POLBAPEX1HTTTHRB
Phthalic Acid SCHEMBL4599263 0.78 TDP1 (0.51) TDP1POLBAPEX1HTTTHRB
SCHEMBL42893 0.78 HCAR2 (0.51) TDP1POLBAPEX1HTTTHRB
SCHEMBL13579532 0.77 TDP1 (0.48) TDP1POLBAPEX1HTTTHRB
Methane SCHEMBL4468486 0.77 HCAR2 (0.50) TDP1POLBAPEX1HTTTHRB
SCHEMBL21371 0.77 TDP1 (0.61) TDP1POLBAPEX1HTTTHRB
SCHEMBL436276 0.77 LMNA (0.61) TDP1POLBAPEX1HTTTHRB
SCHEMBL17784934 0.77 MAPT (0.54) TDP1POLBAPEX1HTTTHRB
SCHEMBL9402746 0.76 TSHR (0.55) TDP1POLBAPEX1HTTTHRB

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
CN-104914675-A Photosensitivity siloxane and hyperbranched polyether polyol-containing photosensitive resin composition used for used for three-dimensional rapid moulding LEDAO STRATEGIC MATERIALS CO LTD 2015-09-16 CN disclosed