SCHEMBL8335180

SCHEMBL8335180

CC(C)OC(=O)N1CCC(=NO)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CHRNA7 P36544 1/20 0.48
GPR119 Q8TDV5 8/20 0.36
GAA P10253 1/20 0.36
SLC6A15 Q9H2J7 1/20 0.36
FAAH O00519 1/20 0.34
ALDH1A1 P00352 1/20 0.33
LMNA P02545 1/20 0.33
HRH2 P25021 1/20 0.33
HRH1 P35367 1/20 0.33
PDK2 Q15119 1/20 0.33
CHRM2 P08172 1/20 0.33
CHRM1 P11229 1/20 0.33
GRM5 P41594 1/20 0.32
GRM1 Q13255 1/20 0.32
MMP1 P03956 1/20 0.32
MMP3 P08254 1/20 0.32
MMP7 P09237 1/20 0.32
MMP9 P14780 1/20 0.32
MMP8 P22894 1/20 0.32
MMP13 P45452 1/20 0.32

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
SCHEMBL304030 0.79 LIPE (0.41) GPR119SLC6A15FAAHHRH2HRH1
SCHEMBL14434131 0.78 CHRNA7 (0.44) CHRNA7GAASLC6A15ALDH1A1LMNA
SCHEMBL26317513 0.78 TSHR (0.43) GPR119GAAFAAHALDH1A1HRH2
SCHEMBL27979621 0.78
SCHEMBL14434126 0.76 ALDH1A1 (0.52) GAAALDH1A1LMNA
SCHEMBL417717 0.75 USP2 (0.51) GPR119ALDH1A1LMNA
SCHEMBL2654623 0.74 TSHR (0.40) GPR119FAAHALDH1A1LMNAHRH2
SCHEMBL5412873 0.74 ALDH1A1 (0.42) GPR119GAAFAAHALDH1A1
SCHEMBL7381267 0.73 ABHD6 (0.38) GPR119SLC6A15GRM5GRM1
SCHEMBL12283406 0.72 ALDH1A1 (0.45) GPR119GAAALDH1A1LMNAMMP1

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
WO-2004101558-A1 2-IMIDAZO-BENZOTHIAZOLES AS ADENOSINE RECEPTOR LIGANDS F. HOFFMANN-LA ROCHE AG (CH) 2004-11-25 WO disclosed