SCHEMBL6524962

SCHEMBL6524962

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

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NOD1 Q9Y239 1/20 0.46
HTR6 P50406 10/20 0.42
CYP3A4 P08684 1/20 0.41
CYP2D6 P10635 1/20 0.41
PCSK9 Q8NBP7 1/20 0.41
PSEN1 P49768 4/20 0.40
PSEN2 P49810 4/20 0.40
APH1B Q8WW43 4/20 0.40
NCSTN Q92542 4/20 0.40
APH1A Q96BI3 4/20 0.40
PSENEN Q9NZ42 4/20 0.40
KDM4E B2RXH2 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
LMNA P02545 1/20 0.40
HPGD P15428 1/20 0.40
TSHR P16473 1/20 0.40
HTT P42858 1/20 0.40
KMT2A Q03164 1/20 0.40
HSD17B10 Q99714 1/20 0.40

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
SCHEMBL6440415 0.88 PSEN1 (0.48) NOD1HTR6PSEN1PSEN2APH1B
SCHEMBL6435967 0.86 HTR6 (0.54) NOD1HTR6PSEN1PSEN2APH1B
SCHEMBL6526507 0.86 LMNA (0.47) HTR6PSEN1PSEN2APH1BNCSTN
SCHEMBL3561274 0.84 HTR6 (0.45) NOD1HTR6CYP3A4CYP2D6PCSK9
SCHEMBL6440512 0.76 PTGDR2 (0.48) NOD1HTR6PSEN1PSEN2APH1B
SCHEMBL6442219 0.76 PTGDR2 (0.43) NOD1HTR6PSEN1PSEN2APH1B
SCHEMBL6440106 0.74 LMNA (0.51) HTR6PSEN1PSEN2APH1BNCSTN
SCHEMBL6442471 0.74 PSEN1 (0.43) NOD1HTR6PSEN1PSEN2APH1B
SCHEMBL6439680 0.74 HTR6 (0.41) HTR6LMNA
SCHEMBL6436468 0.73 PTGDR (0.45) NOD1HTR6PSEN1PSEN2APH1B

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