SCHEMBL5783141

SCHEMBL5783141

CCCS(=O)(=O)N1CCC(N2C(=O)OCc3cccc(C)c32)CC1.Cc1cccc(Cl)c1S(=O)(=O)N1CCC(N2COCc3ccccc32)CC1

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 9/20 0.52
CCR1 P32246 1/20 0.36
LMNA P02545 1/20 0.35

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
SCHEMBL5430491 0.83 CCR1 (0.48) HTR6CCR1LMNA
SCHEMBL3154719 0.83 HTR6 (0.69) HTR6CCR1
SCHEMBL3152365 0.82 HTR6 (0.64) HTR6LMNA
SCHEMBL3147545 0.80 HTR6 (0.64) HTR6CCR1
SCHEMBL3153497 0.80 HTR6 (0.70) HTR6CCR1
SCHEMBL5435793 0.78 KDM4E (0.46) HTR6LMNA
SCHEMBL5809641 0.78 HTR6 (0.54) HTR6
SCHEMBL3152161 0.77 HTR6 (0.62) HTR6
SCHEMBL3153934 0.77 HTR6 (0.69) HTR6
SCHEMBL3152378 0.76 HTR6 (0.78) HTR6CCR1

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
EP-1648886-A1 BENZOXAZINONE-DERIVED SULFONAMIDE COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2006-04-26 EP claimed
WO-2005014589-A1 BENZOXAZINONE-DERIVED SULFONAMIDE COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS LABORATORIOS DEL DR. ESTEVE S.A. (DE) 2005-02-17 WO claimed
EP-1648886-A1 BENZOXAZINONE-DERIVED SULFONAMIDE COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS LABORATORIOS DEL DR. ESTEVE, S.A. (ES) 2006-04-26 EP disclosed
WO-2005014589-A1 BENZOXAZINONE-DERIVED SULFONAMIDE COMPOUNDS, THEIR PREPARATION AND USE AS MEDICAMENTS LABORATORIOS DEL DR. ESTEVE S.A. (DE) 2005-02-17 WO disclosed