SCHEMBL7908327

SCHEMBL7908327

CC(CC(=O)OOC(=O)CC(C)CC(C)(C)C)CC(C)(C)C.CCCCCCCC(=O)OO

nearest known ligand 0.45

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
LMNA P02545 5/20 0.45
MAPT P10636 3/20 0.42
DGKA P23743 1/20 0.40
MAPK1 P28482 2/20 0.40
NAAA Q02083 2/20 0.38
ALDH1A1 P00352 1/20 0.38
PAM P19021 2/20 0.37
MEN1 O00255 2/20 0.37
KMT2A Q03164 2/20 0.37
KDM4E B2RXH2 1/20 0.37
DUSP3 P51452 1/20 0.37
CES2 O00748 1/20 0.37
GMNN O75496 1/20 0.36
HSP90AA1 P07900 1/20 0.36
BLM P54132 1/20 0.36
NPSR1 Q6W5P4 1/20 0.36
NR1H4 Q96RI1 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
SCHEMBL11717064 0.94 LMNA (0.45) LMNAMAPTDGKAMAPK1NAAA
SCHEMBL7908329 0.93 LMNA (0.49) LMNAMAPTDGKAMAPK1ALDH1A1
SCHEMBL11717068 0.93 LMNA (0.49) LMNAMAPTDGKAMAPK1ALDH1A1
SCHEMBL3294831 0.93 LMNA (0.49) LMNAMAPTDGKAMAPK1ALDH1A1
SCHEMBL9750464 0.91 LMNA (0.46) LMNAMAPTDGKAMAPK1ALDH1A1
SCHEMBL9175094 0.82 LMNA (0.42) LMNAMAPTDGKAMAPK1ALDH1A1
SCHEMBL10507835 0.82 LMNA (0.46) LMNAMAPTDGKAMAPK1ALDH1A1
SCHEMBL11203213 0.79 KDM4C (0.35) LMNAMAPTBLM
SCHEMBL94333 0.79 CYP2D6 (0.33)
SCHEMBL21199573 0.78 NAAA (0.36) LMNAMAPTDGKAMAPK1NAAA

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-6197895-B1 ADDING A CERTAIN AMOUNT OF AN ORGANIC PEROXIDE INTO THE REACTION VESSEL TO SHORTEN THE TIME FOR CHLORINATION REACTION WITHOUT SACRIFICING THE INITIAL COLORING AND THE HEAT STABILITY KANEKA CORPORATION (JP) 2001-03-06 US disclosed