SCHEMBL4553412

SCHEMBL4553412

Cc1cc2c(c(C(C)(CF)CC(O)(NCc3cc4cnccc4[nH]3)C(F)F)c1)OCC2

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.46
NR3C2 P08235 20/20 0.46
PGR P06401 15/20 0.46

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
SCHEMBL3711393 0.87 NR3C1 (0.52) NR3C1NR3C2PGR
SCHEMBL1931633 0.83 NR3C1 (0.64) NR3C1NR3C2PGR
SCHEMBL1931929 0.82 NR3C1 (0.60) NR3C1NR3C2PGR
SCHEMBL3760230 0.81 NR3C1 (0.57) NR3C1NR3C2PGR
SCHEMBL4557422 0.79 NR3C1 (0.59) NR3C1NR3C2PGR
SCHEMBL1932140 0.77 NR3C1 (0.47) NR3C1NR3C2PGR
SCHEMBL291801 0.76 NR3C1 (0.78) NR3C1NR3C2PGR
SCHEMBL1932721 0.76 NR3C1 (0.65) NR3C1NR3C2PGR
SCHEMBL6665495 0.75 NR3C1 (0.66) NR3C1NR3C2PGR
SCHEMBL27764333 0.75 NR3C1 (0.58) NR3C1NR3C2PGR

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-2121670-A2 SYNTHESIS OF SELECTED STEREOISOMERS OF CERTAIN SUBSTITUTED ALCOHOLS Bausch & Lomb Incorporated (US) 2009-11-25 EP disclosed
WO-2008088969-A2 SYNTHESIS OF SELECTED STEREOISOMERS OF CERTAIN SUBSTITUTED ALCOHOLS BAUSCH & LOMB INCORPORATED (US) 2008-07-24 WO disclosed