SCHEMBL11244161

SCHEMBL11244161

COc1ccc(C(=O)Nc2ccccc2NC(=O)c2ccc(OC)c(OC)c2)cc1OC

nearest known ligand 0.81

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PDE4D Q08499 1/20 0.81
CHEK1 O14757 1/20 0.78
PIM1 P11309 1/20 0.78
MAPK8 P45983 1/20 0.78
CLK4 Q9HAZ1 1/20 0.78
NPSR1 Q6W5P4 1/20 0.75
ALDH1A1 P00352 2/20 0.72
KMT2A Q03164 3/20 0.68
KDM4E B2RXH2 1/20 0.68
POLB P06746 3/20 0.68
TOP1 P11387 1/20 0.68
PKM P14618 1/20 0.67
MEN1 O00255 2/20 0.67
LMNA P02545 1/20 0.65
MAPT P10636 1/20 0.65
CYP1A2 P05177 1/20 0.65
CYP3A4 P08684 1/20 0.65
CYP2C19 P33261 1/20 0.65
NPC1 O15118 1/20 0.65
NQO2 P16083 1/20 0.65

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
SCHEMBL13576585 0.94 PDE4D (0.76) PDE4DCHEK1PIM1MAPK8CLK4
SCHEMBL30452165 0.91 PDE4D (0.72) PDE4DCHEK1PIM1MAPK8CLK4
SCHEMBL23202497 0.91 PDE4D (0.72) PDE4DCHEK1PIM1MAPK8CLK4
SCHEMBL8414778 0.90 PDE4D (0.67) PDE4DCHEK1PIM1MAPK8CLK4
SCHEMBL266327 0.88 CHEK1 (0.80) PDE4DCHEK1PIM1MAPK8CLK4
SCHEMBL10026584 0.88 CHEK1 (1.00) PDE4DCHEK1PIM1MAPK8CLK4
SCHEMBL7367182 0.88 CHEK1 (0.80) PDE4DCHEK1PIM1MAPK8CLK4
SCHEMBL21829022 0.87 KMT2A (0.69) PDE4DCHEK1PIM1MAPK8CLK4
SCHEMBL23202626 0.87 ALDH1A1 (0.67) PDE4DCHEK1PIM1MAPK8CLK4
SCHEMBL266453 0.86 CHEK1 (0.76) PDE4DCHEK1PIM1MAPK8CLK4

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-4342875-A STABILIZERS FOR OLEFIN POLYMERS CINCINNATI-MILACRON, INC. (US) 1982-08-03 US disclosed