SCHEMBL5329097

SCHEMBL5329097

CN1CCN(Cc2c(CSc3ccccc3)[nH]c3ccccc23)CC1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
DRD2 P14416 3/20 0.52
DRD4 P21917 3/20 0.52
DRD3 P35462 3/20 0.52
CHRNA7 P36544 2/20 0.46
HTR6 P50406 1/20 0.46
POLB P06746 2/20 0.46
HRH4 Q9H3N8 1/20 0.43
MC4R P32245 1/20 0.42
MAPT P10636 3/20 0.42
KMT2A Q03164 3/20 0.42
GAA P10253 2/20 0.42
KDM4E B2RXH2 2/20 0.42
HTT P42858 2/20 0.42
TAAR1 Q96RJ0 1/20 0.42
CHIA Q9BZP6 1/20 0.41
L3MBTL1 Q9Y468 1/20 0.41
GRIN2B Q13224 1/20 0.40
MPO P05164 1/20 0.40
ALDH1A1 P00352 2/20 0.39
HTR2A P28223 2/20 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
SCHEMBL5330012 0.89 HTR2A (0.49) DRD2DRD4DRD3CHRNA7HTR6
SCHEMBL5334148 0.87 POLB (0.44) DRD2DRD4DRD3CHRNA7HTR6
SCHEMBL5332260 0.87 POLB (0.44) DRD2DRD4DRD3CHRNA7HTR6
SCHEMBL5331577 0.87 MPO (0.48) DRD2DRD4DRD3CHRNA7HTR6
SCHEMBL5329102 0.85 KDM4E (0.46) DRD2DRD3HTR6POLBKMT2A
SCHEMBL5334658 0.82 DRD2 (0.46) DRD2DRD4DRD3CHRNA7POLB
SCHEMBL5333420 0.77 MPO (0.47) DRD2DRD4DRD3POLBKDM4E
SCHEMBL5332148 0.77 KMT2A (0.44) POLBMAPTKMT2AGAAKDM4E
SCHEMBL946707 0.77 POLB (0.67) DRD2DRD4DRD3CHRNA7HTR6
SCHEMBL5335447 0.76 DRD2 (0.50) DRD2DRD4DRD3CHRNA7HTR6

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