SCHEMBL4648947

SCHEMBL4648947

O=S(=O)(c1ccccc1)c1cnc2c(OC3CCNCC3)cccc2c1

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 7/20 0.58
HTR2A P28223 4/20 0.58
HTR1A P08908 2/20 0.58
DRD2 P14416 1/20 0.58
HTR7 P34969 1/20 0.58
JAK2 O60674 1/20 0.45
JAK1 P23458 1/20 0.45
TYK2 P29597 1/20 0.45
JAK3 P52333 1/20 0.45
IKBKB O14920 3/20 0.43
CHUK O15111 3/20 0.43
HRH1 P35367 3/20 0.43
ROCK1 Q13464 2/20 0.41
LCK P06239 1/20 0.41
PIM1 P11309 2/20 0.41
PIM2 Q9P1W9 2/20 0.41
HTR2B P41595 1/20 0.39
AKT1 P31749 1/20 0.39
SLC6A2 P23975 1/20 0.38
SLC6A3 Q01959 1/20 0.38

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
SCHEMBL4649524 0.94 HTR1A (0.53) HTR6HTR2AHTR1ADRD2HTR7
SCHEMBL4649903 0.94 HTR1A (0.53) HTR6HTR2AHTR1ADRD2HTR7
SCHEMBL4649526 0.94 HTR1A (0.53) HTR6HTR2AHTR1ADRD2HTR7
SCHEMBL4649236 0.87 HTR1A (0.52) HTR6HTR2AHTR1ADRD2HTR7
SCHEMBL4650645 0.85 HTR6 (0.54) HTR6HTR2AHTR1ADRD2HTR7
SCHEMBL4756585 0.82 HTR6 (0.51) HTR6HTR2AHTR1ADRD2HTR7
SCHEMBL4650003 0.82 HTR6 (0.51) HTR6HTR2AHTR1ADRD2HTR7
SCHEMBL4649908 0.82 HTR6 (0.51) HTR6HTR2AHTR1ADRD2HTR7
SCHEMBL2450282 0.81 HTR6 (0.61) HTR6HTR2AHTR1ADRD2HTR7
Hydrochloric Acid SCHEMBL951642 0.80 HTR6 (0.60) HTR6HTR2AHTR1ADRD2HTR7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1730112-B1 3-((HETERO)ARYLSULFONYL)-8'[ (AMINOALKYL)OXY]QUINOLINES AS 5-HT6 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CNS DISORDERS GLAXO GROUP LTD (GB) 2008-09-03 EP claimed
US-20070191345-A1 3-((Hetero)arylsulfonyl)-8-'(aminoalkyl)oxyquinolines as 5-ht6 receptor antagonists for the treatment of cns disorders GLAXO GROUP LIMITED (GB) 2007-08-16 US claimed
EP-1730112-A1 3-((HETERO)ARYLSULFONYL)-8'[ (AMINOALKYL)OXY]QUINOLINES AS 5-HT6 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CNS DISORDERS GLAXO GROUP LIMITED (GB) 2006-12-13 EP claimed
WO-2005095346-A1 3-((HETERO)ARYLSULFONYL)-8-` (AMINOALKYL)OXY!QUINOLINES AS 5-HT6 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CNS DISORDERS GLAXO GROUP LIMITED (GB) 2005-10-13 WO claimed
EP-1730112-B1 3-((HETERO)ARYLSULFONYL)-8'[ (AMINOALKYL)OXY]QUINOLINES AS 5-HT6 RECEPTOR ANTAGONISTS FOR THE TREATMENT OF CNS DISORDERS GLAXO GROUP LTD (GB) 2008-09-03 EP disclosed
US-20070191345-A1 3-((Hetero)arylsulfonyl)-8-'(aminoalkyl)oxyquinolines as 5-ht6 receptor antagonists for the treatment of cns disorders GLAXO GROUP LIMITED (GB) 2007-08-16 US disclosed
US-20070191345-A1 3-((Hetero)arylsulfonyl)-8-'(aminoalkyl)oxyquinolines as 5-ht6 receptor antagonists for the treatment of cns disorders GLAXO GROUP LIMITED (GB) 2007-08-16 US disclosed
US-20070191345-A1 3-((Hetero)arylsulfonyl)-8-'(aminoalkyl)oxyquinolines as 5-ht6 receptor antagonists for the treatment of cns disorders GLAXO GROUP LIMITED (GB) 2007-08-16 US disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20070191345-A1 3-((Hetero)arylsulfonyl)-8-'(aminoalkyl)oxyquinolines as 5-ht6 receptor antagonists for the treatment of cns disorders HTR6, HTR3B, HTR2C HTR6 1/4885HTR2A 4/4885HTR1A 7/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.