SCHEMBL7776190

SCHEMBL7776190

O=Cc1cc(CCO)cc2c1CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2

nearest known ligand 0.52

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TBXAS1 P24557 9/20 0.52
TBXA2R P21731 9/20 0.52
HDAC8 Q9BY41 2/20 0.48

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
SCHEMBL7778067 0.88 TBXAS1 (0.56) TBXAS1TBXA2RHDAC8
SCHEMBL7778070 0.88 TBXAS1 (0.56) TBXAS1TBXA2RHDAC8
SCHEMBL8115031 0.86 TBXAS1 (0.52) TBXAS1TBXA2RHDAC8
SCHEMBL8113815 0.86 TBXAS1 (0.52) TBXAS1TBXA2RHDAC8
SCHEMBL9015475 0.83 TBXA2R (0.52) TBXAS1TBXA2RHDAC8
SCHEMBL9015416 0.83 HDAC8 (0.52) TBXAS1TBXA2RHDAC8
SCHEMBL7776162 0.82 TBXAS1 (0.72) TBXAS1TBXA2RHDAC8
SCHEMBL9015472 0.81 TBXAS1 (0.74) TBXAS1TBXA2RHDAC8
SCHEMBL8105704 0.81 TBXA2R (0.48) TBXAS1TBXA2RHDAC8
SCHEMBL7779014 0.80 TBXA2R (0.58) TBXAS1TBXA2RHDAC8

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0864561-B1 Benzenesulfonylamine derivatives,process for their preparation and pharmaceutical compositions containing them ADIR (FR) 2001-09-05 EP disclosed
US-6013667-A Benzenesulfonylamine compounds, process for preparing them and pharmaceutical compositions ADIR ET COMPAGNIE (FR) 2000-01-11 US disclosed
EP-0864561-A1 Benzenesulfonylamine derivatives,process for their preparation and pharmaceutical compositions containing them ADIR ET COMPAGNIE (FR) 1998-09-16 EP disclosed