SCHEMBL6435967

SCHEMBL6435967

[CH2]COc1c(C)n(S(=O)(=O)c2ccc(F)cc2)c2ccccc12

nearest known ligand 0.54

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 8/20 0.54
ALDH3A1 P30838 2/20 0.47
PTGDR2 Q9Y5Y4 7/20 0.46
PTGDR Q13258 3/20 0.46
NOD1 Q9Y239 2/20 0.45
NOD2 Q9HC29 1/20 0.45
PSEN1 P49768 1/20 0.41
PSEN2 P49810 1/20 0.41
APH1B Q8WW43 1/20 0.41
NCSTN Q92542 1/20 0.41
APH1A Q96BI3 1/20 0.41
PSENEN Q9NZ42 1/20 0.41

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
SCHEMBL6526507 0.88 LMNA (0.47) HTR6PSEN1PSEN2APH1BNCSTN
SCHEMBL6440415 0.88 PSEN1 (0.48) HTR6ALDH3A1PTGDR2PTGDRNOD1
SCHEMBL6524962 0.86 NOD1 (0.46) HTR6NOD1PSEN1PSEN2APH1B
SCHEMBL3563139 0.84 HTR6 (0.56) HTR6ALDH3A1PTGDR2PTGDRNOD1
SCHEMBL6444246 0.84 PTGDR2 (0.48) HTR6PTGDR2PTGDRNOD1NOD2
SCHEMBL6440894 0.84 PTGDR2 (0.47) HTR6PTGDR2PTGDRNOD1NOD2
SCHEMBL6440512 0.76 PTGDR2 (0.48) HTR6ALDH3A1PTGDR2PTGDRNOD1
SCHEMBL6439680 0.76 HTR6 (0.41) HTR6PTGDR2PTGDR
SCHEMBL6442219 0.76 PTGDR2 (0.43) HTR6ALDH3A1PTGDR2PTGDRNOD1
SCHEMBL6442221 0.74 AVPR1B (0.37) HTR6PSEN1PSEN2APH1BNCSTN

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