SCHEMBL7605568

SCHEMBL7605568

COc1cc(F)cc(-c2ccc3c(c2)C(C)(C)OC(=O)N3)c1.COc1cc(F)cc(-c2ccc3c(c2)C(C)(C)OC(=S)N3)c1

nearest known ligand 0.87

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PGR P06401 20/20 0.87
NR3C1 P04150 2/20 0.60
NR3C2 P08235 2/20 0.60
AR P10275 2/20 0.60

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
SCHEMBL3881351 0.93 PGR (1.00) PGR
SCHEMBL3872475 0.93 PGR (0.74) PGRNR3C1NR3C2AR
SCHEMBL3870520 0.83 PGR (1.00) PGR
SCHEMBL3871809 0.83 PGR (0.82) PGRNR3C1NR3C2AR
SCHEMBL3870564 0.78 PGR (1.00) PGRNR3C1NR3C2AR
SCHEMBL3871920 0.78 PGR (1.00) PGR
SCHEMBL3871662 0.77 PGR (0.73) PGRNR3C1NR3C2AR
SCHEMBL3873313 0.77 PGR (1.00) PGR
SCHEMBL14144952 0.77 PGR (0.73) PGRNR3C1NR3C2AR
SCHEMBL3870572 0.77 PGR (1.00) PGRNR3C1NR3C2AR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1175411-A1 CYCLOTHIOCARBAMATE DERIVATIVES AS PROGESTERONE RECEPTOR MODULATORS American Home Products Corporation (US) 2002-01-30 EP disclosed
WO-2000066570-A1 CYCLOTHIOCARBAMATE DERIVATIVES AS PROGESTERONE RECEPTOR MODULATORS AMERICAN HOME PRODUCTS CORPORATION (US) 2000-11-09 WO disclosed