SCHEMBL1015639

SCHEMBL1015639

COC(=O)CN1CCC(c2cccc(S(=O)(=O)c3ccccc3)c2O)C1

nearest known ligand 0.43

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.43
DRD3 P35462 4/20 0.37
HRH3 Q9Y5N1 1/20 0.37
DRD4 P21917 2/20 0.37
CCNT1 O60563 1/20 0.36
CDK9 P50750 1/20 0.36
DRD2 P14416 1/20 0.36
CACNA1G O43497 1/20 0.36
SFRP1 Q8N474 1/20 0.36
CCR8 P51685 1/20 0.35
KDM4E B2RXH2 1/20 0.35
ALDH1A1 P00352 1/20 0.35

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
SCHEMBL1015497 0.86 HTR6 (0.45) HTR6DRD3HRH3DRD2SFRP1
SCHEMBL1015637 0.83 SFRP1 (0.41) HTR6SFRP1CCR8
SCHEMBL1015804 0.75 HTR6 (0.48) HTR6
SCHEMBL1015805 0.75 HTR6 (0.48) HTR6
SCHEMBL1013506 0.73 HTR6 (0.48) HTR6DRD4
SCHEMBL26986820 0.70 SLC18A3 (0.58) DRD3DRD4DRD2
SCHEMBL1015495 0.69 SFRP1 (0.51) HTR6DRD3DRD2SFRP1
SCHEMBL4078059 0.69 HTR6 (0.45) HTR6CCR8
SCHEMBL1012908 0.68 HTR6 (0.41) HTR6DRD3HRH3DRD2KDM4E
SCHEMBL1016232 0.67 HTR6 (0.40) HTR6DRD3DRD4DRD2SFRP1

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-2081890-B1 ARYLSULFONYL PYRROLIDINES AS 5-HT6 INHIBITORS HOFFMANN LA ROCHE (CH) 2011-01-12 EP disclosed
US-7776910-B2 Arylsulfonyl pyrrolidines as 5-HT6 inhibitors ROCHE PALO ALTO LLC (US) 2010-08-17 US disclosed