SCHEMBL10801466

SCHEMBL10801466

CCOc1ccc(OCCOc2ccccc2)cc1

nearest known ligand 0.75

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 3/20 0.75
NQO1 P15559 1/20 0.67
L3MBTL1 Q9Y468 3/20 0.62
LMNA P02545 1/20 0.62
MAPK1 P28482 1/20 0.62
KCNA3 P22001 1/20 0.61
RELA Q04206 1/20 0.61
CYP1A2 P05177 2/20 0.60
CYP2C19 P33261 2/20 0.60
TDP1 Q9NUW8 2/20 0.60
CYP2D6 P10635 1/20 0.60
ALDH1A1 P00352 2/20 0.55
PKM P14618 1/20 0.55
CHRNB2 P17787 1/20 0.55
CHRNB4 P30926 1/20 0.55
CHRNA3 P32297 1/20 0.55
CHRNA7 P36544 1/20 0.55
CHRNA4 P43681 1/20 0.55
KDM4E B2RXH2 1/20 0.55
SMN1; SMN2 Q16637 1/20 0.55

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
Phenetole SCHEMBL18492 0.90
Phenetole SCHEMBL10779391 0.90 LTA4H (0.81) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL499918 0.90 LTA4H (0.81) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL9011910 0.88 LTA4H (0.65) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL4014413 0.87 LTA4H (0.77) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL14954246 0.87 LTA4H (0.77) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL28696840 0.87 LTA4H (0.77) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL11569608 0.87 LTA4H (0.77) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL3991967 0.87 LTA4H (0.77) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL28364557 0.87 LTA4H (0.77) LTA4HNQO1L3MBTL1LMNAMAPK1

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-4659643-A A PHENOXY COMPOUND KANZAKI PAPER MANUFACTURING CO. LTD. (JP) 1987-04-21 US disclosed