SCHEMBL1966404

SCHEMBL1966404

O=C1COc2ccc(S(=O)(=O)N(Cc3ccc(Cl)cc3)c3cccc(N4CCOCC4)c3)cc2N1

nearest known ligand 0.53

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD4 P21917 3/20 0.51
CNR2 P34972 1/20 0.48
KMT2A Q03164 3/20 0.46
DRD3 P35462 3/20 0.46
DRD2 P14416 2/20 0.46
HTR1A P08908 2/20 0.45
HTR2A P28223 2/20 0.45
CHRM5 P08912 1/20 0.45
ADRA2A P08913 1/20 0.45
ADRA2B P18089 1/20 0.45
ADRA1B P35368 1/20 0.45
TMEM97 Q5BJF2 1/20 0.45
SIGMAR1 Q99720 1/20 0.45
POLB P06746 1/20 0.45
HTR2C P28335 1/20 0.44
HTR7 P34969 1/20 0.44
HTR6 P50406 1/20 0.44
TRPV1 Q8NER1 1/20 0.44
PRNP P04156 1/20 0.43
PIK3CA P42336 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
SCHEMBL318081 0.86 DRD4 (0.39) DRD4CNR2KMT2ADRD3DRD2
SCHEMBL306481 0.80 PARP1 (0.42) DRD4CNR2KMT2APOLBTRPV1
SCHEMBL3263279 0.78 DRD4 (0.50) DRD4KMT2ADRD3DRD2HTR1A
SCHEMBL1968022 0.78 KMT2A (0.48) DRD4KMT2ADRD3DRD2HTR1A
SCHEMBL3376941 0.77 POLB (0.49) KMT2APOLBPRNPMEN1MAPT
SCHEMBL302209 0.77 CNR2 (0.51) CNR2KMT2ADRD3HTR1AHTR2A
SCHEMBL3263275 0.77 TSHR (0.50) DRD4KMT2APOLBTRPV1MEN1
SCHEMBL302050 0.76 HTR2C (0.53) CNR2KMT2ADRD3HTR1AHTR2A
SCHEMBL303627 0.74 HTR2C (0.39) DRD4CNR2KMT2ADRD3DRD2
SCHEMBL301830 0.74 HTR2C (0.61) CNR2KMT2ADRD3HTR1AHTR2A

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-2334637-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-06-22 EP disclosed