SCHEMBL6174967

SCHEMBL6174967

CCC(C)(O)n1cnc2ccccc21

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
FDPS P14324 1/20 0.46
TDP1 Q9NUW8 1/20 0.44
HTT P42858 3/20 0.41
CYP11B1 P15538 4/20 0.40
CYP11B2 P19099 4/20 0.40
APAF1 O14727 1/20 0.40
TNF P01375 1/20 0.40
MAPT P10636 2/20 0.40
HPGD P15428 2/20 0.40
HSD17B10 Q99714 2/20 0.40
NPC1 O15118 1/20 0.40
ALDH1A1 P00352 1/20 0.40
RAB9A P51151 1/20 0.40
LMNA P02545 2/20 0.40
SMN1; SMN2 Q16637 2/20 0.40
EGLN3 Q9H6Z9 1/20 0.40
FGFR1 P11362 1/20 0.39
ASAH1 Q13510 1/20 0.39
TP53 P04637 1/20 0.39
THRB P10828 1/20 0.39

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
SCHEMBL22393709 0.83 TDP1 (0.47) FDPSTDP1HTTCYP11B1CYP11B2
SCHEMBL6175276 0.82 FDPS (0.46) FDPSTDP1HTTCYP11B1CYP11B2
SCHEMBL2614317 0.78 NPC1 (0.49) FDPSTDP1HTTCYP11B1CYP11B2
SCHEMBL19738704 0.77 TDP1 (0.44) FDPSTDP1HTTCYP11B1CYP11B2
SCHEMBL18714716 0.77 TDP1 (0.44) FDPSTDP1HTTCYP11B1CYP11B2
SCHEMBL11578320 0.75 NPC1 (0.43) FDPSTDP1APAF1MAPTHPGD
SCHEMBL14268957 0.74 ALDH1A1 (0.47) FDPSHTTAPAF1MAPTHPGD
SCHEMBL2164037 0.74 EGLN3 (0.45) FDPSAPAF1MAPTHPGDHSD17B10
SCHEMBL4013913 0.73 FDPS (0.46) FDPSTDP1HTTAPAF1HPGD
SCHEMBL3796582 0.73 SMN1; SMN2 (0.44) FDPSTDP1HTTAPAF1MAPT

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
EP-1392280-A4 ARYLSULFONAMIDE ETHERS, AND METHODS OF USE THEREOF WARNER LAMBERT CO (US) 2005-11-30 EP disclosed
EP-1392280-A2 ARYLSULFONAMIDE ETHERS, AND METHODS OF USE THEREOF Abbott GmbH & Co. KG (DE) 2004-03-03 EP disclosed
WO-2002089749-A2 ARYLSULFONAMIDE ETHERS, AND METHODS OF USE THEREOF ABBOTT GMBH & CO.KG (DE) 2002-11-14 WO disclosed