SCHEMBL3352191

SCHEMBL3352191

CNC(=O)CN1CCC(n2ccc3ccc(N)cc32)CC1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SCD O00767 1/20 0.47
HTR1A P08908 1/20 0.42
HTR1D P28221 1/20 0.42
HTR1B P28222 1/20 0.42
HTR1F P30939 1/20 0.42
DRD2 P14416 1/20 0.42
SLC6A4 P31645 1/20 0.42
OPRL1 P41146 7/20 0.41
RAD52 P43351 2/20 0.40
GFER P55789 1/20 0.38
OPRM1 P35372 3/20 0.38
USP2 O75604 1/20 0.37
SMN1; SMN2 Q16637 1/20 0.37
TLR9 Q9NR96 1/20 0.37
TLR8 Q9NR97 1/20 0.37
TLR7 Q9NYK1 1/20 0.37
MAPK10 P53779 1/20 0.37
IRAK4 Q9NWZ3 1/20 0.37
HTR2A P28223 1/20 0.37
HTR7 P34969 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
SCHEMBL3357844 0.86 ABL1 (0.44) SCDHTR1AHTR1DHTR1BHTR1F
SCHEMBL3355552 0.86 DRD2 (0.42) SCDHTR1AHTR1DHTR1BHTR1F
SCHEMBL13537407 0.84 SCD (0.45) SCDHTR1AHTR1DHTR1BHTR1F
SCHEMBL3354906 0.84 ABL1 (0.44) SCDHTR1AHTR1DHTR1BHTR1F
SCHEMBL3354101 0.83 L3MBTL1 (0.48) SCDHTR1AHTR1DHTR1BHTR1F
SCHEMBL3355691 0.80 DRD2 (0.52) SCDHTR1AHTR1DHTR1BHTR1F
SCHEMBL3358885 0.78 DRD2 (0.67) SCDHTR1AHTR1DHTR1BHTR1F
SCHEMBL3352865 0.76 HTR1D (0.51) SCDHTR1AHTR1DHTR1BHTR1F
SCHEMBL3358927 0.75 DRD2 (0.50) SCDHTR1AHTR1DHTR1BHTR1F
SCHEMBL3354646 0.75 NTSR1 (0.51) USP2SMN1; SMN2TLR7

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-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 EP disclosed
EP-2141163-A1 Substituted thiazolidinones, their production and utilisation as medicine Bayer Schering Pharma AG (DE) 2010-01-06 EP disclosed