SCHEMBL20734718

SCHEMBL20734718

CC(C)(S)CC(=O)OCCn1c(=O)n(CCOC(=O)CC(C)(C)S)c(=O)n(CCOC(=O)CC(C)(C)S)c1=O

nearest known ligand 0.41

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GAA P10253 2/20 0.41
POLB P06746 1/20 0.41
NPSR1 Q6W5P4 1/20 0.41
KDM4E B2RXH2 2/20 0.39
ALDH1A1 P00352 3/20 0.37
MEN1 O00255 2/20 0.35
KMT2A Q03164 2/20 0.35
ADORA2B P29275 1/20 0.34
TDP1 Q9NUW8 1/20 0.33
GSK3A P49840 1/20 0.31
GSK3B P49841 1/20 0.31
MAPT P10636 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
SCHEMBL869221 0.79 DGKA (0.37) ALDH1A1TDP1MAPT
SCHEMBL17800991 0.79 GAA (0.50) GAAPOLBNPSR1KDM4EALDH1A1
SCHEMBL996037 0.76 GAA (0.43) GAAPOLBNPSR1KDM4EALDH1A1
SCHEMBL19652445 0.76 GAA (0.66) GAAPOLBNPSR1KDM4EALDH1A1
SCHEMBL1756074 0.75 NAAA (0.43) POLBNPSR1ALDH1A1MEN1KMT2A
SCHEMBL19433047 0.74 ALDH1A1 (0.35) ALDH1A1MAPT
SCHEMBL17049401 0.73 GAA (0.53) GAAPOLBNPSR1KDM4EALDH1A1
SCHEMBL301234 0.73 FNTA (0.44) GAAPOLBNPSR1KDM4EALDH1A1
SCHEMBL8724484 0.73 GAA (0.45) GAAPOLBNPSR1KDM4EALDH1A1
SCHEMBL409438 0.72 GAA (0.57) GAAPOLBNPSR1KDM4EALDH1A1

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
US-10675842-B2 Transparent electrode and organic electronic device including the same Konica Minolta, Inc. (JP) 2020-06-09 US disclosed
US-20190047258-A1 TRANSPARENT ELECTRODE AND ORGANIC ELECTRONIC DEVICE INCLUDING THE SAME MERCK PATENT GMBH (DE) 2019-02-14 US disclosed