SCHEMBL6575474

SCHEMBL6575474

Cc1ccc(S(=O)(=O)c2cc(C)c3c(c2)c(CCN)cn3C)cc1

nearest known ligand 0.46

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.46
GAA P10253 1/20 0.39
HTR2A P28223 1/20 0.39
ADRB2 P07550 1/20 0.37
HTR1D P28221 1/20 0.37
TAAR1 Q96RJ0 1/20 0.37
MTNR1A P48039 3/20 0.37
MTNR1B P49286 3/20 0.37
RAPGEF4 Q8WZA2 1/20 0.36
KMT2A Q03164 2/20 0.35
MEN1 O00255 1/20 0.35
ALDH1A1 P00352 1/20 0.35
MAPT P10636 1/20 0.35

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
Hydrochloric Acid SCHEMBL6579447 0.99 HTR6 (0.46) HTR6GAAHTR2AADRB2HTR1D
SCHEMBL6579474 0.82 ADRB2 (0.53) HTR6GAAHTR2AADRB2HTR1D
Hydrochloric Acid SCHEMBL6577815 0.81 ADRB2 (0.52) HTR6GAAHTR2AADRB2HTR1D
SCHEMBL6577839 0.72 HTR2A (0.57) HTR6HTR2AADRB2HTR1D
Hydrochloric Acid SCHEMBL6580166 0.72 HTR2A (0.56) HTR6HTR2AADRB2HTR1D
SCHEMBL27873084 0.69 ADRB2 (0.58) HTR6HTR2AADRB2HTR1DMTNR1A
SCHEMBL18404868 0.68 HTR2A (0.63) HTR6HTR2AADRB2HTR1DTAAR1
SCHEMBL6577326 0.68 HTR1D (0.68) HTR6HTR2AHTR1DTAAR1KMT2A
SCHEMBL7163717 0.68 HTR6 (0.43) HTR6GAAMTNR1AMTNR1BKMT2A
SCHEMBL27867012 0.68 ADRB2 (0.57) HTR6HTR2AADRB2HTR1DMTNR1A

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-1411925-A1 5-ARYLSULFONYL INDOLES HAVING 5-HT6 RECEPTOR AFFINITY PHARMACIA & UPJOHN COMPANY (US) 2004-04-28 EP claimed
WO-2003011284-A1 5-ARYLSULFONYL INDOLES HAVING 5-HT6 RECEPTOR AFFINITY PHARMACIA & UPJOHN COMPANY (US) 2003-02-13 WO claimed