SCHEMBL4454490

SCHEMBL4454490

CC(O)(Cc1cc2cnccc2[nH]1)CC(C)(c1ccc(F)cc1)C(F)(F)F

nearest known ligand 0.62

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.62
NR3C2 P08235 16/20 0.62
PGR P06401 12/20 0.62
CYP3A4 P08684 2/20 0.52

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
SCHEMBL15135768 0.90 NR3C1 (0.61) NR3C1NR3C2PGRCYP3A4
SCHEMBL291534 0.85 NR3C1 (0.76) NR3C1NR3C2PGRCYP3A4
SCHEMBL4448705 0.84 NR3C1 (0.56) NR3C1NR3C2PGRCYP3A4
SCHEMBL6385024 0.84 NR3C1 (0.52) NR3C1NR3C2PGRCYP3A4
SCHEMBL3687823 0.83 NR3C1 (0.78) NR3C1NR3C2PGR
SCHEMBL5255163 0.82 NR3C1 (0.74) NR3C1NR3C2PGRCYP3A4
SCHEMBL292642 0.77 NR3C1 (0.82) NR3C1NR3C2PGRCYP3A4
SCHEMBL299927 0.76 NR3C1 (1.00) NR3C1NR3C2PGRCYP3A4
SCHEMBL292902 0.76 NR3C1 (0.87) NR3C1NR3C2PGRCYP3A4
SCHEMBL1634081 0.76 NR3C1 (0.85) NR3C1NR3C2PGRCYP3A4

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-2051736-A2 COMPOSITIONS COMPRISING A DISSOCIATED GLUCOCORTICOID RECEPTOR AGONIST AND AN IMMUNOSUPPRESSIVE AGENT FOR TREATING DRY EYE Bausch & Lomb Incorporated (US) 2009-04-29 EP disclosed
WO-2008005686-A2 COMPOSITIONS COMPRISING A DISSOCIATED GLUCOCORTICOID RECEPTOR AGONIST AND AN IMMUNOSUPPRESSIVE AGENT FOR TREATING DRY EYE BAUSCH & LOMB INCORPORATED (US) 2008-01-10 WO disclosed