SCHEMBL3323052

SCHEMBL3323052

CN1CCC(c2n[nH]c3ccc(NS(=O)(=O)c4cccc5ccccc45)cc23)CC1

nearest known ligand 0.69

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 16/20 0.69
GHSR Q92847 2/20 0.47
HTR2A P28223 1/20 0.43
HTR2C P28335 1/20 0.43
BRD4 O60885 1/20 0.43

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
SCHEMBL3147519 0.85 HTR6 (0.60) HTR6BRD4
SCHEMBL3320144 0.85 HTR6 (0.53) HTR6GHSRHTR2AHTR2CBRD4
SCHEMBL4201696 0.83 HTR6 (0.69) HTR6HTR2AHTR2C
Hydrochloric Acid SCHEMBL4204164 0.83 HTR6 (0.68) HTR6HTR2AHTR2C
SCHEMBL13947345 0.82 HTR6 (0.69) HTR6GHSRHTR2AHTR2C
SCHEMBL3154435 0.82 HTR6 (1.00) HTR6
Hydrochloric Acid SCHEMBL3154479 0.81 HTR6 (0.98) HTR6
SCHEMBL3143108 0.80 HTR6 (0.56) HTR6GHSR
SCHEMBL13947342 0.77 HTR6 (0.52) HTR6GHSRHTR2AHTR2CBRD4
SCHEMBL5309686 0.76 HTR6 (0.42) HTR6

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-20100120747-A1 COMBINATION OF A CHOLINESTERASE INHIBITOR AND A COMPOUND WITH 5-HT6 RECEPTOR AFFINITY LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2010-05-13 US disclosed
US-20090005417-A1 Substituted Indazolyl Sulfonamide and 2,3-Dihydro-Indolyl Sulfonamide Compounds, their Preparation and Use in Medicaments LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2009-01-01 US disclosed
US-20090005417-A1 Substituted Indazolyl Sulfonamide and 2,3-Dihydro-Indolyl Sulfonamide Compounds, their Preparation and Use in Medicaments LABORATORIOS DEL DR. ESTEVE S.A. (ES) 2009-01-01 US disclosed
CN-101133034-A Substituted indazolyl sulfonamide and 2,3-dihydro-indolyl sulfonamide compounds, their preparation and use in medicaments ESTEVE LABOR DR (ES) 2008-02-27 CN 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 (2 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-20100120747-A1 COMBINATION OF A CHOLINESTERASE INHIBITOR AND A COMPOUND WITH 5-HT6 RECEPTOR AFFINITY HTR6, AANAT, ACHE HTR6 1/4885GHSR 358/4885HTR2A 16/4885
US-20090005417-A1 Substituted Indazolyl Sulfonamide and 2,3-Dihydro-Indolyl Sulfonamide Compounds, their Preparation and Use in Medicaments HTR6, TPH2, HTR5A HTR6 1/4885GHSR 905/4885HTR2A 5/4885

“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.