SCHEMBL5655899

SCHEMBL5655899

C=Cc1ccccc1S(=O)(=O)Nc1ccc2[nH]cc(CCN(CC)CC)c2c1

nearest known ligand 0.73

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 16/20 0.73
HTR1A P08908 3/20 0.48
HTR1D P28221 2/20 0.47
MPO P05164 1/20 0.47
HTR1B P28222 1/20 0.47

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
SCHEMBL3143198 0.85 HTR6 (1.00) HTR6HTR1AHTR1DMPO
Hydrochloric Acid SCHEMBL3142854 0.84 HTR6 (0.98) HTR6HTR1AHTR1DMPO
SCHEMBL3323841 0.83 HTR6 (0.74) HTR6HTR1AHTR1DMPOHTR1B
SCHEMBL3156930 0.81 HTR6 (1.00) HTR6HTR1AHTR1DHTR1B
SCHEMBL3144603 0.80 HTR6 (1.00) HTR6HTR1AHTR1DMPOHTR1B
SCHEMBL3147480 0.79 HTR6 (1.00) HTR6HTR1AHTR1DHTR1B
SCHEMBL3143201 0.78 HTR6 (0.89) HTR6HTR1AHTR1DHTR1B
SCHEMBL5659589 0.78 HTR6 (0.53) HTR6HTR1AHTR1DMPOHTR1B
SCHEMBL4970689 0.77 HTR6 (0.83) HTR6HTR1AHTR1DMPOHTR1B
SCHEMBL3156829 0.77 HTR6 (1.00) HTR6HTR1AHTR1DMPOHTR1B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-7176200-B2 Derivatives of sulphonamides, their preparation and use as medicaments LABORATORIES DEL DR. ESTEVE, S.A. (ES) 2007-02-13 US disclosed
US-20050032791-A1 Such as N-[3-(2-diethylaminoethyl)-1H-indol-5-yl]-5-chloro-3-methylbenzo[b]thiophene-2-sulphonamide for treating anxiety, depression, cognitive memory disorders and senile dementia, psychosis, infant hyperkinesia (ADHD, attention deficit/hyperactivity disorder) MERC-VIDAL RAMON (ES) 2005-02-10 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-20050032791-A1 Such as N-[3-(2-diethylaminoethyl)-1H-indol-5-yl]-5-chloro-3-methylbenzo[b]thiophene-2-sulphonamide for treating anxiety, depression, cognitive memory disorders and senile dementia, psychosis, infant hyperkinesia (ADHD, attention deficit/hyperactivity disorder) CHAT, SLC6A3, PSEN2 HTR6 10/4885HTR1A 26/4885HTR1D 80/4885

“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.