SCHEMBL4785772

SCHEMBL4785772

O=S(=O)(NCCc1ccccn1)c1cn(S(=O)(=O)c2ccccc2)c2cccc(Br)c12

nearest known ligand 0.45

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.45
KDM4E B2RXH2 1/20 0.42
MAPT P10636 1/20 0.42
RAB9A P51151 1/20 0.41
HTT P42858 1/20 0.39
ATM Q13315 1/20 0.39
ADORA3 P0DMS8 2/20 0.39
ADORA2B P29275 2/20 0.39
ADORA1 P30542 2/20 0.39
SMN1; SMN2 Q16637 1/20 0.38
LMNA P02545 1/20 0.37
TDP1 Q9NUW8 1/20 0.37
PRMT5 O14744 1/20 0.37
WDR77 Q9BQA1 1/20 0.37
MET P08581 1/20 0.37
TSHR P16473 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
SCHEMBL4781064 0.89 HTR6 (0.43) HTR6KDM4EMAPTRAB9AHTT
SCHEMBL14207924 0.88 HTR6 (0.43) HTR6KDM4EMAPTRAB9AHTT
SCHEMBL4784044 0.88 KDM4E (0.44) HTR6KDM4EMAPTRAB9AHTT
SCHEMBL4783936 0.87 KDM4E (0.46) HTR6KDM4EMAPTRAB9AHTT
SCHEMBL4784743 0.86 HTR6 (0.41) HTR6KDM4EMAPTRAB9AHTT
SCHEMBL4784058 0.86 HTR6 (0.41) HTR6KDM4EMAPTRAB9AHTT
SCHEMBL4782431 0.86 HTT (0.43) HTR6KDM4EMAPTRAB9AHTT
SCHEMBL4784750 0.86 NSD2 (0.46) HTR6MAPT
SCHEMBL4783444 0.83 TBXAS1 (0.48) HTR6SMN1; SMN2TDP1
SCHEMBL4784579 0.75 TDP1 (0.54) HTR6MAPTHTTSMN1; SMN2LMNA

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO claimed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed
WO-2008060998-A1 INDOLE SULFONAMIDES AS SFRP-1 MODULATORS WYETH (US) 2008-05-22 WO disclosed