SCHEMBL4413034

SCHEMBL4413034

Cc1c(S(=O)(=O)n2c(S(=O)(=O)Cl)cc3c4c(ccc32)OCCN(C)C4)sc2ccc(Cl)cc12

nearest known ligand 0.43

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 19/20 0.43
HTR2A P28223 5/20 0.37
HTR7 P34969 5/20 0.37
DRD2 P14416 4/20 0.37
HTR1A P08908 2/20 0.37
HTR1D P28221 2/20 0.37
HTR1B P28222 2/20 0.37
HTR2C P28335 1/20 0.37
HTR1E P28566 1/20 0.37
HTR1F P30939 1/20 0.37
ADRA1B P35368 1/20 0.37
DRD3 P35462 1/20 0.37
HTR2B P41595 1/20 0.37
HTR4 Q13639 1/20 0.37
NPSR1 Q6W5P4 1/20 0.37
L3MBTL1 Q9Y468 1/20 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
SCHEMBL4413032 0.85 HTR6 (0.55) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL1992946 0.84 HTR6 (0.56) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL4412448 0.73 HTR6 (0.42) HTR6
SCHEMBL4413035 0.70 HTR6 (0.51) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL2003562 0.67 HTR6 (0.48) HTR6DRD3
SCHEMBL337593 0.67 NPSR1 (0.62) NPSR1L3MBTL1
SCHEMBL1994662 0.66 HTR6 (0.44) HTR6L3MBTL1
SCHEMBL12577072 0.64 HTR6 (0.56) HTR6HTR2AHTR7DRD2HTR1A
SCHEMBL2001617 0.64 HTR6 (0.38) HTR6HTR2ADRD2HTR1ANPSR1
SCHEMBL13598936 0.64 HTR6 (0.58) HTR6HTR2AHTR7DRD2HTR1A

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-2091953-A1 8-SULFONYL-L, 3, 4, 8-TETRAHYDR0-2H- [1, 4]OXAZEPINO [6, 7-E]INDOLE DERIVATIVES AND THEIR USE AS 5-HT6 RECEPTOR LIGANDS BIOVITRUM AB (publ) (SE) 2009-08-26 EP disclosed
WO-2008054288-A1 8-SULFONYL-L, 3, 4, 8-TETRAHYDR0-2H- [1, 4] OXAZEPINO [6, 7-E] INDOLE DERIVATIVES AND THEIR USE AS 5-HT6 RECEPTOR LIGANDS BIOVITRUM AB (PUBL) (SE) 2008-05-08 WO disclosed