SCHEMBL9854773

SCHEMBL9854773

COc1ccc(OC(C)=O)c(CCOc2ccccc2)c1

nearest known ligand 0.54

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
MTNR1B P49286 7/20 0.54
MTNR1A P48039 7/20 0.54
HPGD P15428 1/20 0.48
HSD17B10 Q99714 1/20 0.47
LMNA P02545 1/20 0.45
MAPT P10636 1/20 0.45
L3MBTL1 Q9Y468 1/20 0.45
NPC1 O15118 1/20 0.44
RAB9A P51151 1/20 0.44
BACE1 P56817 1/20 0.44

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
SCHEMBL10909359 0.81 POLB (0.60) MTNR1BMTNR1AHPGDHSD17B10BACE1
SCHEMBL27512435 0.80 MTNR1B (0.57) MTNR1BMTNR1AHSD17B10MAPTBACE1
SCHEMBL9854748 0.77 MTNR1A (0.49) MTNR1BMTNR1AHPGDHSD17B10LMNA
SCHEMBL8675359 0.76 PKM (0.61) MTNR1BMTNR1ALMNAMAPTL3MBTL1
SCHEMBL9517976 0.75 ELANE (0.59) MTNR1BMTNR1ALMNAMAPTL3MBTL1
SCHEMBL48106 0.75 MTNR1A (0.59) MTNR1BMTNR1AHSD17B10
SCHEMBL10908806 0.75 ALDH1A1 (0.50) MTNR1BMTNR1AHPGDHSD17B10LMNA
SCHEMBL3961218 0.74 FFAR1 (0.64) MAPTNPC1RAB9A
Nitrogen SCHEMBL11410837 0.74 MAPT (0.50) MTNR1BMTNR1AMAPTNPC1RAB9A
SCHEMBL3957122 0.73 HSD17B10 (0.56) MTNR1BMTNR1AHPGDHSD17B10LMNA

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-0428423-A2 Aryloxy alkyl benzenes, processes for their preparation and pharmaceutical compositions containing them LIPHA S.A. (FR) 1991-05-22 EP disclosed