SCHEMBL4630173

SCHEMBL4630173

CN1CCC(Nc2cccc(S(=O)(=O)c3cc4cc(Cl)ccc4[nH]3)c2)CC1

nearest known ligand 0.45

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
HRH4 Q9H3N8 6/20 0.45
HRH3 Q9Y5N1 3/20 0.45
POLB P06746 1/20 0.44
HTR6 P50406 6/20 0.44
HRH1 P35367 1/20 0.42
HTR2C P28335 3/20 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
ROCK2 O75116 1/20 0.39
ROCK1 Q13464 1/20 0.39
LMNA P02545 1/20 0.38
HTT P42858 1/20 0.38
VCP P55072 1/20 0.38

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
SCHEMBL4629550 0.92 POLB (0.44) HRH4HRH3POLBHTR6HTR2C
SCHEMBL4630178 0.88 HTR6 (0.44) HRH4HRH3POLBHTR6HTR2A
SCHEMBL4629545 0.88 VCP (0.47) HRH4HTR6HTR2CHTR2AVCP
Hydrochloric Acid SCHEMBL4628914 0.87 VCP (0.46) HRH4HTR6HTR2CHTR2AHTR1A
SCHEMBL4630016 0.87 CA2 (0.46) HRH4HRH3HTR6HTTVCP
SCHEMBL4630008 0.85 HTR6 (0.42) HRH4HRH3HTR6ROCK2LMNA
SCHEMBL4721182 0.83 CYP3A4 (0.46) HRH4HRH3POLBHRH1HTR2C
SCHEMBL4629706 0.83 HTR6 (0.45) HRH4POLBHTR6HTR2CHTR2A
SCHEMBL4630164 0.81 CYP3A4 (0.56) HRH4HRH3HTR6HRH1HTR2C
SCHEMBL16986603 0.78 POLB (0.44) 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 4 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
EP-1919896-A1 AMINOARYL SULPHONAMIDE DERIVATIVES AS FUNCTIONAL 5-HT6 LIGANDS. Suven Life Sciences Limited (IN) 2008-05-14 EP disclosed
WO-2007020652-A1 AMINOARYL SULPHONAMIDE DERIVATIVES AS FUNCTIONAL 5-HT6 LIGANDS. SUVEN LIFE SCIENCES LIMITED (IN) 2007-02-22 WO disclosed