SCHEMBL7003079

SCHEMBL7003079

c1ccc(CCN2CC3CN(CCc4ccccc4)CC3C2)cc1

nearest known ligand 0.65

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
SLC6A3 Q01959 1/20 0.61
SIGMAR1 Q99720 2/20 0.59
ACHE P22303 1/20 0.56
GBA1 P04062 1/20 0.56
CCR3 P51677 1/20 0.55
HRH3 Q9Y5N1 1/20 0.53
HTR1A P08908 1/20 0.53
DRD2 P14416 1/20 0.53
MAOA P21397 1/20 0.52
HTR2A P28223 1/20 0.51
HTR2C P28335 1/20 0.51
KCNH2 Q12809 1/20 0.51

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
SCHEMBL17286012 0.92 ACHE (0.54) SLC6A3SIGMAR1ACHEGBA1CCR3
SCHEMBL7523207 0.92 SLC6A3 (0.57) SLC6A3SIGMAR1ACHEGBA1CCR3
SCHEMBL17284517 0.91 SLC6A3 (0.52) SLC6A3SIGMAR1ACHEGBA1CCR3
SCHEMBL22878369 0.91 SLC6A3 (0.52) SLC6A3SIGMAR1ACHEGBA1CCR3
SCHEMBL7383124 0.88 SLC6A3 (0.53) SLC6A3SIGMAR1ACHEGBA1CCR3
SCHEMBL7383573 0.88 HRH3 (0.58) SLC6A3SIGMAR1ACHEGBA1CCR3
SCHEMBL7383126 0.88 SLC6A3 (0.53) SLC6A3SIGMAR1ACHEGBA1CCR3
SCHEMBL7385498 0.88 HRH3 (0.58) SLC6A3SIGMAR1ACHEGBA1CCR3
SCHEMBL13755814 0.88 SLC6A3 (0.58) SLC6A3SIGMAR1ACHEGBA1CCR3
SCHEMBL7383578 0.88 HRH3 (0.58) SLC6A3SIGMAR1ACHEGBA1CCR3

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-1360187-A1 3,7-DIAZABICYCLO(3.3.0)OCTANES AND THEIR USE IN THE TREATMENT OF CARDIAC ARRHYTHMIAS AstraZeneca AB (SE) 2003-11-12 EP claimed
WO-2002060902-A1 3,7-DIAZABICYCLO[3.3.0]OCTANES AND THEIR USE IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2002-08-08 WO claimed
EP-1360187-A1 3,7-DIAZABICYCLO(3.3.0)OCTANES AND THEIR USE IN THE TREATMENT OF CARDIAC ARRHYTHMIAS AstraZeneca AB (SE) 2003-11-12 EP disclosed
WO-2002060902-A1 3,7-DIAZABICYCLO[3.3.0]OCTANES AND THEIR USE IN THE TREATMENT OF CARDIAC ARRHYTHMIAS ASTRAZENECA AB (SE) 2002-08-08 WO disclosed