SCHEMBL4199473

SCHEMBL4199473

CCCCOC(=O)N1CCN(CC[C]=O)CC1

nearest known ligand 0.54

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 2/20 0.54
LMNA P02545 1/20 0.54
POLB P06746 1/20 0.54
HRH2 P25021 16/20 0.52
HRH1 P35367 16/20 0.52
HRH3 Q9Y5N1 1/20 0.44
ADORA3 P0DMS8 1/20 0.43
HTR2A P28223 1/20 0.43
HTR7 P34969 1/20 0.43
OPRM1 P35372 1/20 0.43
SIGMAR1 Q99720 1/20 0.43
ALDH1A1 P00352 1/20 0.43
MAPT P10636 1/20 0.43

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
SCHEMBL28015674 0.84 HRH2 (0.54) SMN1; SMN2LMNAPOLBHRH2HRH1
SCHEMBL9405372 0.82 POLB (0.73) SMN1; SMN2LMNAPOLBHRH2HRH1
SCHEMBL30404652 0.82 SMN1; SMN2 (0.56) SMN1; SMN2LMNAPOLBHRH2HRH1
SCHEMBL3966262 0.82 SMN1; SMN2 (0.56) SMN1; SMN2LMNAPOLBHRH2HRH1
SCHEMBL46979 0.82 SMN1; SMN2 (0.56) SMN1; SMN2LMNAPOLBHRH2HRH1
SCHEMBL29991910 0.81 HRH2 (0.56) SMN1; SMN2LMNAPOLBHRH2HRH1
SCHEMBL27166403 0.81 HRH2 (0.56) SMN1; SMN2LMNAPOLBHRH2HRH1
SCHEMBL5544347 0.80 HRH2 (0.53) SMN1; SMN2LMNAPOLBHRH2HRH1
SCHEMBL5594524 0.79 POLB (0.65) SMN1; SMN2LMNAPOLBHRH2HRH1
SCHEMBL5546645 0.79 HRH2 (0.52) SMN1; SMN2LMNAPOLBHRH2HRH1

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
EP-2032559-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION AstraZeneca AB (SE) 2009-03-11 EP disclosed
WO-2007138268-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2007-12-06 WO disclosed