SCHEMBL13792201

SCHEMBL13792201

CCCn1c(CCCc2ccc(OC)cc2)cn(Cc2ccc(F)cc2)c1=O

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
RGS4 P49798 2/20 0.45
RGS8 P57771 2/20 0.45
ALDH1A1 P00352 4/20 0.43
KDM4E B2RXH2 4/20 0.43
PROKR1 Q8TCW9 1/20 0.41
GRM2 Q14416 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.40
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
USP2 O75604 1/20 0.39
PKM P14618 1/20 0.39
TSHR P16473 1/20 0.39
MAPK1 P28482 1/20 0.39
HTT P42858 1/20 0.39
L3MBTL1 Q9Y468 1/20 0.39
LMNA P02545 1/20 0.39
P2RX7 Q99572 1/20 0.39
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38

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
SCHEMBL13793140 0.92 P2RX7 (0.40) RGS4RGS8ALDH1A1KDM4ESMN1; SMN2
SCHEMBL13793172 0.91 CYP11B1 (0.40) PROKR1CYP11B1CYP11B2
SCHEMBL13793121 0.90 PPARA (0.46) RGS4MAPTCYP11B1CYP11B2
SCHEMBL13792802 0.90 SIGMAR1 (0.44) RGS4RGS8PROKR1MAPTL3MBTL1
SCHEMBL13792152 0.89 ALDH1A1 (0.43) ALDH1A1KDM4EKMT2AMAPTHTT
SCHEMBL13792829 0.87 NPBWR1 (0.41) ALDH1A1PROKR1GRM2SMN1; SMN2MAPT
SCHEMBL13793024 0.87 PPARA (0.44) ALDH1A1SMN1; SMN2KMT2AMEN1MAPT
SCHEMBL13792786 0.87 L3MBTL1 (0.42) RGS4RGS8ALDH1A1KDM4EUSP2
SCHEMBL13792168 0.86 PROKR1 (0.43) ALDH1A1PROKR1SMN1; SMN2KMT2AMEN1
SCHEMBL13793093 0.85 PPARG (0.40) ALDH1A1KDM4ESMN1; SMN2KMT2AMAPT

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-7544812-B2 For example, 2-(4-{2-[1-(4-tert-Butyl-benzyl)-3-methyl-2-oxo-imidazolidin-4-yl]-ethoxy}-2-methyl-phenoxy)-2-methyl-propionic acid, 2-(4-{3-[1-(4-tert-Butyl-benzyl)-3-methyl-2-oxo-imidazolidin-4-yl]-propyl}-2-methyl-phenoky)-2-methyl-propionic acid; for treating diabetes mellitus ELI LILLY AND COMPANY (US) 2009-06-09 US disclosed
US-7544812-B2 For example, 2-(4-{2-[1-(4-tert-Butyl-benzyl)-3-methyl-2-oxo-imidazolidin-4-yl]-ethoxy}-2-methyl-phenoxy)-2-methyl-propionic acid, 2-(4-{3-[1-(4-tert-Butyl-benzyl)-3-methyl-2-oxo-imidazolidin-4-yl]-propyl}-2-methyl-phenoky)-2-methyl-propionic acid; for treating diabetes mellitus ELI LILLY AND COMPANY (US) 2009-06-09 US disclosed