SCHEMBL7776609

SCHEMBL7776609

C[Si](C)(C)c1ccc2c(c1C(=O)O)CCC(NS(=O)(=O)c1ccc(Cl)cc1)C2

nearest known ligand 0.59

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
TBXA2R P21731 10/20 0.59
HDAC8 Q9BY41 2/20 0.52
TBXAS1 P24557 8/20 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
SCHEMBL8105728 0.87 TBXA2R (0.56) TBXA2RHDAC8TBXAS1
SCHEMBL9015468 0.86 TBXA2R (0.70) TBXA2RHDAC8TBXAS1
SCHEMBL7771706 0.86 TBXA2R (0.61) TBXA2RHDAC8TBXAS1
SCHEMBL9015454 0.84 TBXA2R (0.60) TBXA2RHDAC8TBXAS1
SCHEMBL7777991 0.83 TBXA2R (0.53) TBXA2RHDAC8TBXAS1
SCHEMBL7776067 0.82 TBXA2R (0.52) TBXA2RHDAC8TBXAS1
SCHEMBL9015411 0.82 TBXA2R (0.60) TBXA2RHDAC8TBXAS1
SCHEMBL9015465 0.80 TBXA2R (0.60) TBXA2RHDAC8TBXAS1
SCHEMBL9253927 0.78 TBXA2R (0.65) TBXA2RHDAC8TBXAS1
SCHEMBL9015509 0.78 TBXA2R (0.55) TBXA2RHDAC8TBXAS1

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
EP-0648741-B1 1,2,3,4-Tetrahydronaphthalene, chroman and thiochroman derivatives as antithrombotic agents ADIR (FR) 1996-12-18 EP disclosed
EP-0648741-A1 1,2,3,4-Tetrahydronaphthalene, chroman and thiochroman derivatives as antithrombotic agents ADIR ET COMPAGNIE (FR) 1995-04-19 EP disclosed