SCHEMBL17580792

SCHEMBL17580792

O=S(=O)(c1cccc(N2CC3CNCC3C2)c1)c1cnc2ccc(N3CC4CNCC4C3)cc2c1

nearest known ligand 0.43

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.42
BPTF Q12830 1/20 0.41
CHRNB2 P17787 3/20 0.41
CHRNA4 P43681 3/20 0.41
CHRNA7 P36544 2/20 0.41
HTR2A P28223 3/20 0.40
HTR7 P34969 2/20 0.40
HTR1A P08908 1/20 0.40
DRD2 P14416 1/20 0.40
NAMPT P43490 1/20 0.37
KHK P50053 1/20 0.36

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
SCHEMBL17580791 0.92 CHRNB2 (0.46) HTR6BPTFCHRNB2CHRNA4CHRNA7
SCHEMBL17580927 0.92 HTR6 (0.46) HTR6CHRNB2CHRNA4CHRNA7HTR2A
SCHEMBL17580665 0.89 PIK3CA (0.42) HTR6NAMPT
SCHEMBL17580778 0.87 PIM1 (0.49) HTR6NAMPT
SCHEMBL17580661 0.86 HTR6 (0.40) HTR6BPTFCHRNB2CHRNA4CHRNA7
SCHEMBL17580612 0.85 HTR6 (0.44) HTR6BPTFCHRNB2CHRNA4CHRNA7
SCHEMBL17580617 0.85 HTR6 (0.42) HTR6HTR2A
SCHEMBL17580675 0.85 HTR6 (0.44) HTR6HTR2AHTR7HTR1ADRD2
SCHEMBL17580798 0.83 HTR6 (0.44) HTR6HTR2AHTR7HTR1ADRD2
SCHEMBL3643424 0.83 HTR6 (0.58) HTR6BPTFCHRNB2CHRNA4CHRNA7

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
EP-2185555-B1 QUINOLINE COMPOUNDS SUITABLE FOR TREATING DISORDERS THAT RESPOND TO MODULATION OF THE SEROTONIN 5-HT6 RECEPTOR ABBVIE DEUTSCHLAND (DE) 2016-03-16 EP claimed