SCHEMBL9903085

SCHEMBL9903085

Cc1ccc(S(=O)(=O)c2cnc3ccc(N4CCNCC4)cc3c2)cc1

nearest known ligand 0.57

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 17/20 0.57
HTR1A P08908 2/20 0.48
HTR7 P34969 2/20 0.48
DRD2 P14416 1/20 0.48
HTR2A P28223 1/20 0.48
ADRB1 P08588 1/20 0.47
CHRNB2 P17787 1/20 0.44
CHRNA4 P43681 1/20 0.44
HTR1D P28221 1/20 0.43
HTR1B P28222 1/20 0.43
HTR2B P41595 1/20 0.43
HTR5A P47898 1/20 0.43
KDM4E B2RXH2 1/20 0.42
ALDH1A1 P00352 1/20 0.42
LMNA P02545 1/20 0.42

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
SCHEMBL9902743 0.89 HTR6 (0.50) HTR6HTR1AHTR7DRD2HTR2A
SCHEMBL4690981 0.88 HTR6 (0.61) HTR6HTR1AHTR7DRD2HTR2A
SCHEMBL9903357 0.87 HTR6 (0.59) HTR6HTR7DRD2HTR2AHTR2B
SCHEMBL9903063 0.86 HTR6 (0.43) HTR6HTR1AHTR7DRD2HTR2A
SCHEMBL9903634 0.84 HTR6 (0.50) HTR6HTR1AHTR7DRD2HTR2A
SCHEMBL3136898 0.81 HTR6 (0.60) HTR6HTR1AHTR7DRD2HTR2A
SCHEMBL4702293 0.81 CHRNB2 (0.50) HTR6HTR1AHTR7DRD2HTR2A
SCHEMBL9903675 0.79 HTR6 (0.47) HTR6HTR1AHTR7DRD2HTR2A
SCHEMBL9903853 0.77 HTR6 (0.60) HTR6HTR7DRD2HTR2AHTR2B
SCHEMBL9903510 0.77 HTR6 (0.60) HTR6HTR7DRD2HTR2BLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1956004-B1 Quinoline derivatives and their use as 5-HT6 ligands GLAXO GROUP LTD (GB) 2012-06-13 EP claimed