SCHEMBL5771499

SCHEMBL5771499

CCCNC1CCc2ccc3c(ccn3S(=O)(=O)c3ccc(C)cc3)c2C1

nearest known ligand 0.52

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 5/20 0.52
HTR1D P28221 7/20 0.47
HTR1B P28222 3/20 0.47
DRD2 P14416 10/20 0.44
HTR1A P08908 2/20 0.44
DRD3 P35462 8/20 0.43
DRD4 P21917 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
SCHEMBL5775637 0.94 HTR6 (0.51) HTR6HTR1DHTR1BDRD2HTR1A
SCHEMBL3212054 0.88 HTR6 (0.52) HTR6HTR1DHTR1BDRD2HTR1A
SCHEMBL5771847 0.87 HTR6 (0.57) HTR6DRD2HTR1ADRD3
SCHEMBL5774777 0.86 HTR6 (0.56) HTR6DRD2HTR1ADRD3
SCHEMBL5772310 0.84 HTR6 (0.54) HTR6DRD2HTR1ADRD3
SCHEMBL5772333 0.84 HTR6 (0.54) HTR6DRD2HTR1ADRD3
SCHEMBL5738248 0.80 HTR6 (0.59) HTR6DRD2HTR1ADRD3
SCHEMBL13422076 0.79 HTR6 (0.82) HTR6HTR1DHTR1B
SCHEMBL3209365 0.77 HTR6 (0.70) HTR6DRD2HTR1ADRD3
Trifluoroacetic Acid SCHEMBL5737813 0.73 HTR6 (0.53) HTR6DRD2HTR1ADRD3

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1682502-A1 SULFONYLTETRAHYDRO-3H-BENZO(E)INDOLE-8-AMINE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth (US) 2006-07-26 EP claimed
WO-2005047252-A1 SULFONYLTETRAHYDRO-3H-BENZO(E)INDOLE-8-AMINE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2005-05-26 WO claimed
EP-1682502-A1 SULFONYLTETRAHYDRO-3H-BENZO(E)INDOLE-8-AMINE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS Wyeth (US) 2006-07-26 EP disclosed
WO-2005047252-A1 SULFONYLTETRAHYDRO-3H-BENZO(E)INDOLE-8-AMINE COMPOUNDS AS 5-HYDROXYTRYPTAMINE-6 LIGANDS WYETH (US) 2005-05-26 WO disclosed