SCHEMBL6440241

SCHEMBL6440241

[CH2]COc1c(C)n(S(=O)(=O)c2ccc(OC)cc2OC)c2ccccc12

nearest known ligand 0.46

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.44
AVPR1B P47901 5/20 0.42
OXTR P30559 1/20 0.42
PKM P14618 1/20 0.42
SMN1; SMN2 Q16637 3/20 0.41
USP2 O75604 1/20 0.40
ALDH1A1 P00352 1/20 0.40
GAA P10253 1/20 0.40
TSHR P16473 1/20 0.40
RECQL P46063 1/20 0.40
NPSR1 Q6W5P4 1/20 0.40
HTR2C P28335 1/20 0.39
RAPGEF3 O95398 1/20 0.39
MAPK1 P28482 1/20 0.39
GFER P55789 1/20 0.39
PTGDR2 Q9Y5Y4 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
SCHEMBL6438258 0.89 HTR6 (0.42) HTR6AVPR1BOXTRSMN1; SMN2USP2
SCHEMBL3565168 0.85 HTR6 (0.52) HTR6AVPR1BOXTRPKMALDH1A1
SCHEMBL6442221 0.79 AVPR1B (0.37) HTR6AVPR1BSMN1; SMN2TSHRNPSR1
SCHEMBL3555819 0.77 HTR6 (0.54) HTR6AVPR1BOXTRSMN1; SMN2USP2
SCHEMBL3556128 0.75 HTR6 (0.50) HTR6
SCHEMBL3553338 0.74 HTR6 (0.45) HTR6PKMALDH1A1
SCHEMBL6435967 0.74 HTR6 (0.54) HTR6PTGDR2
SCHEMBL6440415 0.74 PSEN1 (0.48) HTR6ALDH1A1GAATSHRPTGDR2
SCHEMBL6526507 0.74 LMNA (0.47) HTR6PKMSMN1; SMN2GAARECQL
SCHEMBL3558220 0.73 HTR6 (0.43) HTR6AVPR1BOXTRSMN1; SMN2USP2

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-1567492-A2 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES Suven Life Sciences Limited (IN) 2005-08-31 EP claimed
WO-2004048328-A2 N-ARYLSULFONYL-3-AMINOALKOXYINDOLES SUVEN LIFE SCIENCES LIMITED (IN) 2004-06-10 WO claimed