SCHEMBL4844922

SCHEMBL4844922

O=S(=O)(Nc1ccccc1)c1ccccc1N1CCNCC1

nearest known ligand 0.62

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 14/20 0.62
HTR1A P08908 2/20 0.46
HTR2A P28223 2/20 0.46
HTR7 P34969 1/20 0.46
HTR5A P47898 1/20 0.46
ADRB1 P08588 2/20 0.46
DRD3 P35462 1/20 0.46
HTR1D P28221 1/20 0.45
HTR1B P28222 1/20 0.45
HTR2C P28335 1/20 0.45
HTR2B P41595 1/20 0.45

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
SCHEMBL17201780 0.86 ALDH1A1 (0.55) HTR6
SCHEMBL3609792 0.83 HTR6 (0.66) HTR6HTR1AHTR2AHTR7HTR5A
SCHEMBL30735820 0.83 HTR6 (0.66) HTR6HTR1AHTR2AHTR7HTR5A
Hydrochloric Acid SCHEMBL6047117 0.82 HTR6 (0.64) HTR6HTR1AHTR2AHTR7HTR5A
SCHEMBL18553769 0.81 HTR6 (0.54) HTR6HTR1AHTR2ADRD3HTR1D
SCHEMBL1380651 0.79 HTR6 (0.60) HTR6HTR1AHTR2AHTR1DHTR1B
Hydrochloric Acid SCHEMBL5550931 0.79 HTR6 (0.59) HTR6HTR1AHTR2AHTR1DHTR1B
SCHEMBL3796417 0.77 HTR6 (1.00) HTR6HTR1AHTR2AHTR7
SCHEMBL18553746 0.77 HTR6 (0.89) HTR6ADRB1HTR2CHTR2B
SCHEMBL8632814 0.76 HTR6 (0.67) HTR6HTR1AHTR2AHTR7HTR5A

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
US-7381728-B2 Piperazine derivatives useful for the treatment of gastrointestinal disorders GLAXO GROUP LIMITED (GB) 2008-06-03 US disclosed
US-20070259877-A1 Piperazine Derivatives Useful for the Treatment of Gastrointestinal Disorders GLAXO GROUP LIMITED 2007-11-08 US disclosed
US-6599904-B2 5-HT6 receptor antagonists are believed to be of potential use in the treatment of certain CNS disorders; cognitive memory enhancement SMITHKLINE BEECHAM P.L.C. (GB) 2003-07-29 US disclosed
US-6423717-B1 NERVOUS SYSTEM DISORDERS SMITHKLINE BEECHAM P.L.C. (GB) 2002-07-23 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-20070259877-A1 Piperazine Derivatives Useful for the Treatment of Gastrointestinal Disorders GHSR, GHRHR, GIPR HTR6 313/4885HTR1A 214/4885HTR2A 133/4885

“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.