SCHEMBL4196493

SCHEMBL4196493

CCCCOC(=O)N1CCC(C)([C]=O)CC1

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SMN1; SMN2 Q16637 4/20 0.55
POLB P06746 2/20 0.55
LMNA P02545 1/20 0.55
OPRD1 P41143 1/20 0.41
OPRK1 P41145 1/20 0.41
HRH2 P25021 5/20 0.39
HRH1 P35367 5/20 0.39
ALDH1A1 P00352 4/20 0.38
HTT P42858 1/20 0.38
L3MBTL1 Q9Y468 1/20 0.37
ATM Q13315 1/20 0.36
TSHR P16473 2/20 0.36
KDM4E B2RXH2 1/20 0.35
TDP1 Q9NUW8 1/20 0.35
GAA P10253 2/20 0.35
NPC1 O15118 1/20 0.35
MAPT P10636 1/20 0.35
RAB9A P51151 1/20 0.35
HPGD P15428 1/20 0.34
BCHE P06276 1/20 0.34

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
SCHEMBL27842859 0.81 POLB (0.58) SMN1; SMN2POLBLMNAOPRD1OPRK1
SCHEMBL346648 0.80 SMN1; SMN2 (0.56) SMN1; SMN2POLBLMNAOPRD1OPRK1
SCHEMBL30136060 0.80 POLB (0.56) SMN1; SMN2POLBLMNAOPRD1OPRK1
SCHEMBL9405372 0.80 POLB (0.73) SMN1; SMN2POLBLMNAHRH2HRH1
SCHEMBL4195731 0.79 POLB (0.55) SMN1; SMN2POLBLMNAOPRD1OPRK1
SCHEMBL30135752 0.79 POLB (0.55) SMN1; SMN2POLBLMNAOPRD1OPRK1
SCHEMBL29948489 0.78 POLB (0.54) SMN1; SMN2POLBLMNAOPRD1OPRK1
SCHEMBL24137712 0.77 POLB (0.60) SMN1; SMN2POLBLMNAOPRD1OPRK1
SCHEMBL30659245 0.77 SMN1; SMN2 (0.56) SMN1; SMN2POLBLMNAOPRD1OPRK1
SCHEMBL3634052 0.77 SMN1; SMN2 (0.69) SMN1; SMN2POLBLMNAHRH2HRH1

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 4 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 claimed
WO-2007138268-A1 2-HETEROCYCLOAMINO-4-IMIDAZOLYLPYRIMIDINES AS AGENTS FOR THE INHIBITION OF CELL PROLIFERATION ASTRAZENECA AB (SE) 2007-12-06 WO claimed
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