SCHEMBL9623943

SCHEMBL9623943

C=Cc1ccc(OCCOC(=O)C(=C)C)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTT P42858 2/20 0.56
POLB P06746 1/20 0.56
APEX1 P27695 1/20 0.56
TDP1 Q9NUW8 1/20 0.56
CHRNB2 P17787 1/20 0.48
CHRNB4 P30926 1/20 0.48
CHRNA3 P32297 1/20 0.48
CHRNA7 P36544 1/20 0.48
CHRNA4 P43681 1/20 0.48
THRB P10828 2/20 0.45
L3MBTL1 Q9Y468 2/20 0.40
TSHR P16473 2/20 0.39
MAPT P10636 2/20 0.39
GAA P10253 1/20 0.39
ALDH1A1 P00352 2/20 0.38
CA1 P00915 1/20 0.38
CA2 P00918 1/20 0.38
LMNA P02545 1/20 0.37
TP53 P04637 1/20 0.37
MEN1 O00255 1/20 0.36

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
Styrene SCHEMBL28678089 0.90 THRB (0.56) HTTPOLBAPEX1TDP1THRB
SCHEMBL454606 0.89 POLB (0.67) HTTPOLBAPEX1TDP1THRB
SCHEMBL6552735 0.88 POLB (0.56) HTTPOLBAPEX1TDP1THRB
SCHEMBL14454645 0.87 POLB (0.55) HTTPOLBAPEX1TDP1THRB
Isopropyl Alcohol SCHEMBL10397953 0.86 POLB (0.51) HTTPOLBAPEX1TDP1THRB
SCHEMBL5549982 0.86 CHRNB2 (0.51) HTTPOLBAPEX1TDP1CHRNB2
SCHEMBL12353262 0.84 POLB (0.52) HTTPOLBAPEX1TDP1THRB
SCHEMBL14173271 0.84 POLB (0.61) HTTPOLBAPEX1TDP1THRB
SCHEMBL11053172 0.84 POLB (0.61) HTTPOLBAPEX1TDP1THRB
SCHEMBL4447276 0.84 POLB (0.61) HTTPOLBAPEX1TDP1THRB

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
EP-0473346-A2 Rewritable organic recording medium, process for the production thereof, and method of recording and erasing TEIJIN LIMITED (JP) 1992-03-04 EP disclosed