SCHEMBL1778034

SCHEMBL1778034

O=S(=O)(c1ccc(Cl)c(Cl)c1)c1ccc2ccnc(N3CCCNCC3)c2c1

nearest known ligand 0.67

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 10/20 0.67
HTR2C P28335 3/20 0.47
SCN9A Q15858 1/20 0.41
HTR1A P08908 4/20 0.40
DRD2 P14416 4/20 0.40
HTR7 P34969 4/20 0.40
HSD11B1 P28845 1/20 0.39
CHRNB2 P17787 1/20 0.39
CHRNA4 P43681 1/20 0.39
PRKCQ Q04759 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
Hydrochloric Acid SCHEMBL1778427 0.99 HTR6 (0.66) HTR6HTR2CSCN9AHTR1ADRD2
SCHEMBL1776331 0.96 HTR6 (0.72) HTR6HTR2CSCN9AHTR1ADRD2
Hydrochloric Acid SCHEMBL1774664 0.95 HTR6 (0.71) HTR6HTR2CSCN9AHTR1ADRD2
SCHEMBL1778549 0.91 HTR6 (0.69) HTR6HTR2CHTR1ADRD2HTR7
Hydrochloric Acid SCHEMBL1781144 0.90 HTR6 (0.67) HTR6HTR2CHTR1ADRD2HTR7
SCHEMBL1775290 0.87 HTR6 (0.70) HTR6HTR2CHTR1ADRD2HTR7
Hydrochloric Acid SCHEMBL1774951 0.86 HTR6 (0.69) HTR6HTR2CHTR1ADRD2HTR7
SCHEMBL1776016 0.86 HTR6 (0.74) HTR6HTR2CHTR1ADRD2HTR7
SCHEMBL1780383 0.85 HTR6 (0.92) HTR6HTR2CHTR1ADRD2HTR7
SCHEMBL1777317 0.85 HTR6 (0.74) HTR6HTR2C

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7943639-B2 Such as 6-benzenesulfonyl-4-piperazin-1-yl-quinoline hydrochloride; for treatment of central nervous system and/or 5- HT6 receptor related disorders; for weight gain/loss PROXIMAGEN LIMITED (GB) 2011-05-17 US claimed
US-7943639-B2 Such as 6-benzenesulfonyl-4-piperazin-1-yl-quinoline hydrochloride; for treatment of central nervous system and/or 5- HT6 receptor related disorders; for weight gain/loss PROXIMAGEN LIMITED (GB) 2011-05-17 US disclosed
EP-1897876-A2 Compounds useful for the treatment of obesity, type II diabetes and CNS disorders Biovitrum AB (publ) (SE) 2008-03-12 EP disclosed
EP-1513828-A1 NEW COMPOUNDS USEFUL FOR THE TREATMENT OF OBESITY, TYPE II DIABETES AND CNS DISORDERS Biovitrum AB (SE) 2005-03-16 EP disclosed
US-20040024210-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2004-02-05 US disclosed
WO-2004000828-A1 NEW COMPOUNDS USEFUL FOR THE TREATMENT OF OBESITY, TYPE II DIABETES AND CNS DISORDERS BIOVITRUM AB (SE) 2003-12-31 WO 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-20040024210-A1 New compounds SULT1E1, SULT2A1, SULT1A1 HTR6 2109/4885HTR2C 1245/4885SCN9A 1098/4885

“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.