SCHEMBL743328

SCHEMBL743328

NCCc1cn(S(N)(=O)=O)c2ccccc12

nearest known ligand 0.71

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 19/20 0.71
HTR2A P28223 1/20 0.57
HTR1A P08908 1/20 0.52
HTR1D P28221 1/20 0.52
HTR1B P28222 1/20 0.52
HTR1F P30939 1/20 0.52
HTR7 P34969 1/20 0.52
DRD3 P35462 1/20 0.52

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
SCHEMBL28314093 0.84 HTR6 (0.68) HTR6HTR2A
SCHEMBL1357126 0.83 HTR6 (1.00) HTR6HTR1AHTR1DHTR1BHTR1F
SCHEMBL9596504 0.80 HTR6 (0.74) HTR6
Oxalic Acid SCHEMBL7441099 0.80 HTR6 (0.65) HTR6HTR2AHTR1DHTR1BHTR7
SCHEMBL3585571 0.79 HTR6 (1.00) HTR6
Oxalic Acid SCHEMBL7433702 0.79 HTR6 (0.90) HTR6HTR1AHTR1DHTR1BHTR1F
SCHEMBL15250049 0.79 HTR6 (1.00) HTR6
SCHEMBL3807170 0.78 HTR6 (0.74) HTR6HTR2A
SCHEMBL28373885 0.74 HTR6 (0.46) HTR6
SCHEMBL7561915 0.74 HTR2A (0.66) HTR6HTR2A

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
EP-2231160-B1 TRYPTAMINE SULFONAMIDES AS 5-HT6 ANTAGONISTS MERCK SHARP & DOHME (US) 2013-08-14 EP disclosed
US-8138219-B2 Tryptamine sulfonamides as 5-HT6 antagonists MERCK SHARP & DOHME CORP. (US) 2012-03-20 US disclosed
US-8138219-B2 Tryptamine sulfonamides as 5-HT6 antagonists MERCK SHARP & DOHME CORP. (US) 2012-03-20 US disclosed
US-20100256106-A1 TRYPTAMINE SULFONAMIDES AS 5-HT6 ANTAGONISTS MERCK & CO., INC. (US) 2010-10-07 US disclosed
EP-2231160-A1 TRYPTAMINE SULFONAMIDES AS 5-HT6 ANTAGONISTS Merck Sharp & Dohme Corp. (US) 2010-09-29 EP disclosed
WO-2009073118-A1 TRYPTAMINE SULFONAMIDES AS 5-HT6 ANTAGONISTS MERCK & CO., INC. (US) 2009-06-11 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-20100256106-A1 TRYPTAMINE SULFONAMIDES AS 5-HT6 ANTAGONISTS HTR6, HTR4, HTR1A HTR6 1/4885HTR2A 5/4885HTR1A 3/4885

“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.