SCHEMBL5784285

SCHEMBL5784285

Cc1cccc2c1N(C1CCN(S(=O)(=O)c3cccc4c(N5C(=O)OCc6ccccc65)cccc34)CC1)C(=O)OC2

nearest known ligand 0.77

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
HTR6 P50406 9/20 0.77
OXTR P30559 2/20 0.42

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
SCHEMBL3143933 0.91 HTR6 (0.74) HTR6OXTR
SCHEMBL3147558 0.87 HTR6 (0.82) HTR6OXTR
SCHEMBL4392098 0.87 HTR6 (1.00) HTR6
SCHEMBL3152968 0.86 HTR6 (0.80) HTR6
SCHEMBL3147464 0.85 HTR6 (0.79) HTR6
SCHEMBL3152367 0.84 HTR6 (0.78) HTR6OXTR
SCHEMBL5785349 0.84 HTR6 (0.67) HTR6OXTR
SCHEMBL4008409 0.84 HTR6 (1.00) HTR6
SCHEMBL3137592 0.83 HTR6 (0.78) HTR6OXTR
SCHEMBL3153201 0.83 HTR6 (0.78) HTR6OXTR

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