SCHEMBL5335447

SCHEMBL5335447

CN1CCN(Cc2c(CS(=O)(=O)c3ccccc3)[nH]c3ccccc23)CC1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.50
DRD4 P21917 3/20 0.50
DRD3 P35462 3/20 0.50
POLB P06746 1/20 0.47
HTR6 P50406 6/20 0.46
CHRNA7 P36544 1/20 0.44
CYP3A4 P08684 1/20 0.42
CYP2D6 P10635 1/20 0.42
HRH4 Q9H3N8 1/20 0.41
MPO P05164 1/20 0.41
MAPT P10636 3/20 0.40
KMT2A Q03164 3/20 0.40
KDM4E B2RXH2 2/20 0.40
HTT P42858 2/20 0.40
MC4R P32245 1/20 0.40
GAA P10253 1/20 0.40
TAAR1 Q96RJ0 1/20 0.40
CHIA Q9BZP6 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 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
SCHEMBL5335619 0.91 MAPT (0.45) DRD2DRD4DRD3POLBHTR6
SCHEMBL5329261 0.91 HTR6 (0.49) DRD2DRD4DRD3POLBHTR6
SCHEMBL5333028 0.87 MPO (0.47) DRD2DRD4DRD3POLBHTR6
SCHEMBL5333140 0.87 HTR6 (0.48) POLBHTR6MAPTKMT2AKDM4E
SCHEMBL5333246 0.87 POLB (0.45) DRD2DRD4DRD3POLBHTR6
SCHEMBL5336199 0.85 HTR6 (0.50) DRD2DRD4DRD3POLBHTR6
SCHEMBL5337329 0.82 DRD2 (0.44) DRD2DRD4DRD3POLBHTR6
SCHEMBL5333822 0.82 MAPT (0.45) DRD2DRD4DRD3HTR6CHRNA7
SCHEMBL5335240 0.78 ALDH1A1 (0.44) DRD2DRD4DRD3POLBHTR6
SCHEMBL5334580 0.78 ALDH1A1 (0.44) DRD2DRD4DRD3POLBHTR6

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
WO-2007046112-A1 ARYLTHIOETHER TRYPTAMINE DERIVATIVES AS FUNCTIONAL 5-HT6 LIGANDS SUVEN LIFE SCIENCES INC. (IN) 2007-04-26 WO claimed
WO-2007046112-A1 ARYLTHIOETHER TRYPTAMINE DERIVATIVES AS FUNCTIONAL 5-HT6 LIGANDS SUVEN LIFE SCIENCES INC. (IN) 2007-04-26 WO disclosed