SCHEMBL1776222

SCHEMBL1776222

CC(C)(C)c1ccc(S(=O)(=O)c2ccc3ccnc(N4CCCNCC4)c3c2)cc1

nearest known ligand 0.68

Predicted protein targets (top 14)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 6/20 0.68
HTR1A P08908 1/20 0.46
HTR1D P28221 1/20 0.46
HTR1B P28222 1/20 0.46
HTR2C P28335 3/20 0.46
PRKCI P41743 2/20 0.44
HRH4 Q9H3N8 2/20 0.41
HRH3 Q9Y5N1 2/20 0.41
HSD11B1 P28845 2/20 0.40
ROCK2 O75116 2/20 0.38
ROCK1 Q13464 2/20 0.38
LMNA P02545 1/20 0.37
GAA P10253 1/20 0.37
NMT1 P30419 1/20 0.37

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 SCHEMBL1780081 0.99 HTR6 (0.67) HTR6HTR1AHTR1DHTR1BHTR2C
SCHEMBL1775290 0.88 HTR6 (0.70) HTR6HTR1AHTR2C
Hydrochloric Acid SCHEMBL1774951 0.87 HTR6 (0.69) HTR6HTR1AHTR2C
SCHEMBL1778549 0.87 HTR6 (0.69) HTR6HTR1AHTR1DHTR2CHRH4
SCHEMBL1780383 0.86 HTR6 (0.92) HTR6HTR1AHTR1DHTR2CNMT1
SCHEMBL1777317 0.86 HTR6 (0.74) HTR6HTR2CPRKCILMNAGAA
Hydrochloric Acid SCHEMBL1781144 0.86 HTR6 (0.67) HTR6HTR1AHTR1DHTR2CHRH4
SCHEMBL1778835 0.85 HTR6 (0.62) HTR6HTR1AHTR1DHTR1BHTR2C
Hydrochloric Acid SCHEMBL1778263 0.85 HTR6 (0.90) HTR6HTR1AHTR1DHTR2CNMT1
Hydrochloric Acid SCHEMBL1780248 0.85 HTR6 (0.72) HTR6HTR2CPRKCILMNAGAA

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 10 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
EP-1897876-A2 Compounds useful for the treatment of obesity, type II diabetes and CNS disorders Biovitrum AB (publ) (SE) 2008-03-12 EP claimed
EP-1513828-A1 NEW COMPOUNDS USEFUL FOR THE TREATMENT OF OBESITY, TYPE II DIABETES AND CNS DISORDERS Biovitrum AB (SE) 2005-03-16 EP claimed
US-20040024210-A1 New compounds PROXIMAGEN NEUROSCIENCE PLC (GB) 2004-02-05 US claimed
WO-2004000828-A1 NEW COMPOUNDS USEFUL FOR THE TREATMENT OF OBESITY, TYPE II DIABETES AND CNS DISORDERS BIOVITRUM AB (SE) 2003-12-31 WO 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 2109/4885HTR1A 1317/4885HTR1D 1478/4885

“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.