SCHEMBL6812414

SCHEMBL6812414

CC(C)(C)OC(=O)On1cccc1-c1ccc2c(c1)C(C)(C)OC(=O)N2

nearest known ligand 0.47

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
PGR P06401 20/20 0.47
AR P10275 4/20 0.43
NR3C1 P04150 3/20 0.43
NR3C2 P08235 3/20 0.43

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
SCHEMBL27508258 0.88 PGR (0.48) PGRARNR3C1NR3C2
SCHEMBL1222819 0.84 PGR (0.48) PGRARNR3C1NR3C2
SCHEMBL6815705 0.78 PGR (0.48) PGRARNR3C1NR3C2
SCHEMBL4167939 0.76 PGR (0.60) PGRARNR3C1NR3C2
SCHEMBL1223203 0.73 PGR (0.66) PGRARNR3C1NR3C2
SCHEMBL4159226 0.73 PGR (0.50) PGRARNR3C1NR3C2
SCHEMBL1222812 0.72 PGR (0.62) PGRARNR3C1NR3C2
SCHEMBL27448644 0.72 PGR (0.47) PGR
SCHEMBL6407654 0.71 PGR (0.47) PGRARNR3C1NR3C2
SCHEMBL5230474 0.70 PGR (0.50) PGR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1173210-B1 CONTRACEPTIVE COMPOSITIONS CONTAINING ANTIPROGESTINIC AND PROGESTINIC WYETH CORP (US) 2004-09-15 EP claimed