SCHEMBL3684852

SCHEMBL3684852

COc1cc(F)ccc1C(C)(CF)CC(O)C(F)F

nearest known ligand 0.37

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 18/20 0.37
NR3C2 P08235 9/20 0.37
PGR P06401 2/20 0.35

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
SCHEMBL3657312 0.90 NR3C1 (0.45) NR3C1NR3C2PGR
SCHEMBL3649794 0.80 CHRM3 (0.37) NR3C1NR3C2PGR
SCHEMBL5800422 0.77 NR3C1 (0.52) NR3C1NR3C2PGR
SCHEMBL3948025 0.74 CYP3A4 (0.33)
SCHEMBL5779282 0.72 NR3C1 (0.44) NR3C1NR3C2PGR
SCHEMBL3680227 0.72 KCNN4 (0.37) NR3C1PGR
SCHEMBL1634224 0.71 NR3C2 (0.44) NR3C1NR3C2PGR
SCHEMBL8225347 0.69 LMNA (0.47) NR3C1NR3C2
SCHEMBL5777930 0.68 NR3C1 (0.42) NR3C1NR3C2PGR
SCHEMBL13347574 0.66 HTR2A (0.45) 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-2190431-A2 COMPOSITIONS COMPRISING A DISSOCIATED GLUCOCORTICOID RECEPTOR AGONIST FOR TREATING OR CONTROLLING ANTERIOR-SEGMENT INFLAMMATION Bausch & Lomb Incorporated (US) 2010-06-02 EP disclosed
WO-2009023471-A2 COMPOSITIONS COMPRISING A DISSOCIATED GLUCOCORTICOID RECEPTOR AGONIST FOR TREATING OR CONTROLLING ANTERIOR-SEGMENT INFLAMMATION BAUSCH & LOMB INCORPORATED (US) 2009-02-19 WO disclosed