SCHEMBL9763744

SCHEMBL9763744

C=C(C)C(=O)OCCC[Si](C)(C)O[Si](O[Si](C)(C)C)(c1ccccc1)c1ccccc1

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
TDP1 Q9NUW8 2/20 0.41
POLB P06746 1/20 0.41
APEX1 P27695 1/20 0.41
HTT P42858 1/20 0.41
TSHR P16473 2/20 0.38
THRB P10828 1/20 0.33
ELANE P08246 1/20 0.32
CA1 P00915 1/20 0.32
CA2 P00918 1/20 0.32
MAPT P10636 2/20 0.31
L3MBTL1 Q9Y468 1/20 0.30
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL17061426 0.96 TDP1 (0.44) TDP1POLBAPEX1HTTTSHR
SCHEMBL25755693 0.90 POLB (0.39) TDP1POLBAPEX1HTTTSHR
SCHEMBL19718526 0.89 POLB (0.39) TDP1POLBAPEX1HTTTSHR
SCHEMBL25755577 0.88 TDP1 (0.41) TDP1POLBAPEX1HTTTSHR
SCHEMBL9764044 0.87 TDP1 (0.45) TDP1POLBAPEX1HTTTSHR
SCHEMBL19398249 0.86 POLB (0.39) TDP1POLBAPEX1HTTTSHR
SCHEMBL19398253 0.86 POLB (0.39) TDP1POLBAPEX1HTTTSHR
SCHEMBL2367678 0.86 TDP1 (0.44) TDP1POLBAPEX1HTTTSHR
SCHEMBL17061428 0.86 TDP1 (0.44) TDP1POLBAPEX1HTTTSHR
SCHEMBL1398279 0.86 TDP1 (0.44) TDP1POLBAPEX1HTTTSHR

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
US-4988788-A Room temperature-curable coating composition SHIN-ETSU CHEMICAL CO., LTD. (JP) 1991-01-29 US claimed