SCHEMBL302085

SCHEMBL302085

Cn1nccc1S(=O)(=O)N(Cc1ccc(Cl)cc1)c1cccc(N2CCOCC2)c1

nearest known ligand 0.47

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
CNR2 P34972 4/20 0.47
HTR2C P28335 6/20 0.45
HTR1A P08908 3/20 0.45
HTR2A P28223 3/20 0.45
HTR7 P34969 3/20 0.45
DRD3 P35462 3/20 0.45
HTR6 P50406 3/20 0.45
EP300 Q09472 1/20 0.42
HIF1A Q16665 1/20 0.42
LMNA P02545 2/20 0.41
POLB P06746 1/20 0.41
PKM P14618 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.38
HTT P42858 1/20 0.38
NPC1 O15118 1/20 0.38
CNR1 P21554 2/20 0.37

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
SCHEMBL304038 0.83 NPC1 (0.42) CNR2HTR2CHTR1AHTR2AHTR7
SCHEMBL302050 0.81 HTR2C (0.53) CNR2HTR2CHTR1AHTR2AHTR7
SCHEMBL1976235 0.78 CNR2 (0.44) CNR2HTR2CHTR1AHTR2AHTR7
SCHEMBL302209 0.77 CNR2 (0.51) CNR2HTR2CHTR1AHTR2AHTR7
SCHEMBL301830 0.75 HTR2C (0.61) CNR2HTR2CHTR1AHTR2AHTR7
SCHEMBL2188016 0.75 KDM4E (0.43) LMNAPOLBPKMHTTNPC1
SCHEMBL301863 0.74 MEN1 (0.49) SMN1; SMN2NPC1
SCHEMBL3281350 0.74 HTR2C (0.53) CNR2HTR2CHTR1AHTR2AHTR7
SCHEMBL1966404 0.73 DRD4 (0.51) CNR2HTR2CHTR1AHTR2AHTR7
SCHEMBL3275347 0.72 HTR2C (0.54) CNR2HTR2CHTR1AHTR2AHTR7

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-2012500835-A 2012-01-12 JP claimed
EP-2334637-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-06-22 EP claimed
EP-2334637-A1 NOVEL POTASSIUM CHANNEL BLOCKERS Xention Limited (GB) 2011-06-22 EP disclosed