SCHEMBL4629550

SCHEMBL4629550

CN1CCC(Nc2cccc(S(=O)(=O)c3cc4ccc(Cl)cc4[nH]3)c2)CC1

nearest known ligand 0.44

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.44
HTR6 P50406 6/20 0.44
HRH4 Q9H3N8 2/20 0.42
HTR2C P28335 3/20 0.40
ITK Q08881 1/20 0.40
HTR2A P28223 1/20 0.40
AKR1B1 P15121 1/20 0.39
HTR1A P08908 2/20 0.39
HTR1D P28221 2/20 0.39
HTR1B P28222 2/20 0.39
HTR7 P34969 2/20 0.39
HTR2B P41595 2/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
F10 P00742 2/20 0.37
CNR1 P21554 1/20 0.37
HRH3 Q9Y5N1 1/20 0.36
MET P08581 1/20 0.36
FLT3 P36888 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
SCHEMBL4630173 0.92 HRH4 (0.45) POLBHTR6HRH4HTR2CHTR2A
SCHEMBL4629732 0.83 CYP3A4 (0.46) POLBHRH4HTR2CITKHTR2A
SCHEMBL4629706 0.83 HTR6 (0.45) POLBHTR6HRH4HTR2CHTR2A
SCHEMBL4629545 0.82 VCP (0.47) HTR6HRH4HTR2CHTR2A
SCHEMBL4630178 0.82 HTR6 (0.44) POLBHTR6HRH4ITKHTR2A
Hydrochloric Acid SCHEMBL4628914 0.82 VCP (0.46) HTR6HRH4HTR2CHTR2AHTR1A
SCHEMBL4630016 0.82 CA2 (0.46) HTR6HRH4HTTCNR1HRH3
SCHEMBL16986603 0.80 POLB (0.44) POLBHTR6HTR2CHTR2AHTR1A
SCHEMBL4630008 0.79 HTR6 (0.42) HTR6HRH4ITKLMNAHRH3
Hydrochloric Acid SCHEMBL2225211 0.79 HTR6 (0.43) POLBHTR6HTR2CHTR2AHTR1A

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-1919896-A1 AMINOARYL SULPHONAMIDE DERIVATIVES AS FUNCTIONAL 5-HT6 LIGANDS. Suven Life Sciences Limited (IN) 2008-05-14 EP claimed
WO-2007020652-A1 AMINOARYL SULPHONAMIDE DERIVATIVES AS FUNCTIONAL 5-HT6 LIGANDS. SUVEN LIFE SCIENCES LIMITED (IN) 2007-02-22 WO claimed