SCHEMBL8207552

SCHEMBL8207552

CN1C2CCC1CC(c1cc3ccccc3n1C)C2

nearest known ligand 0.55

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PROKR1 Q8TCW9 2/20 0.41
SLC6A2 P23975 2/20 0.41
SLC6A3 Q01959 2/20 0.41
KMT2A Q03164 1/20 0.40
HTR3E A5X5Y0 1/20 0.39
HTR3B O95264 1/20 0.39
HTR3A P46098 1/20 0.39
HTR3D Q70Z44 1/20 0.39
HTR3C Q8WXA8 1/20 0.39
CHRM3 P20309 3/20 0.39
CHRM2 P08172 2/20 0.39
CHRM4 P08173 2/20 0.39
CHRM5 P08912 2/20 0.39
CHRM1 P11229 2/20 0.39
ADRA2A P08913 1/20 0.39
DRD2 P14416 1/20 0.39
ADRA2B P18089 1/20 0.39
ADRA2C P18825 1/20 0.39
DRD1 P21728 1/20 0.39
HRH2 P25021 1/20 0.39

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
SCHEMBL17522468 0.83 KMT2A (0.47) PROKR1KMT2AADRA2A
SCHEMBL28620587 0.79 PROKR1 (0.48) PROKR1KMT2ACHRM1ADRA1A
SCHEMBL13197458 0.78 PROKR1 (0.42) PROKR1KMT2AADRA2A
SCHEMBL28201861 0.73 PROKR1 (0.39) PROKR1KMT2AADRA2AHTR2AHTR2C
SCHEMBL16760322 0.72 PROKR1 (0.44) PROKR1CHRM1ADRA2ADRD2HRH1
SCHEMBL8106540 0.71 SLC6A4 (0.54) SLC6A2SLC6A3DRD2SLC6A4
SCHEMBL7334925 0.70 KDM1A (0.47) HTR3EHTR3BHTR3AHTR3DHTR3C
SCHEMBL6347383 0.70 CHRM2 (0.49) PROKR1CHRM3CHRM2CHRM4CHRM5
SCHEMBL633352 0.69 SLC6A2 (0.55) SLC6A2SLC6A3CHRM3CHRM2CHRM4
SCHEMBL633351 0.69 SLC6A2 (0.55) SLC6A2SLC6A3CHRM3CHRM2CHRM4

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-0984965-A1 8-AZABICYCLO(3,2,1)OCT-2-ENE AND OCTANE DERIVATIVES AS CHOLINERGIC LIGANDS AT NICOTINIC ACH RECEPTORS NEUROSEARCH A/S (DK) 2000-03-15 EP claimed
WO-1998054181-A1 8-AZABICYCLO(3,2,1)OCT-2-ENE AND OCTANE DERIVATIVES AS CHOLINERGIC LIGANDS AT NICOTINIC ACH RECEPTORS NEUROSEARCH A/S (DK) 1998-12-03 WO claimed