SCHEMBL3681809

SCHEMBL3681809

COc1ccc(F)cc1C(C)(CC(C)(O)Cc1cc2ncncc2[nH]1)C(F)(F)F

nearest known ligand 0.78

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.78
NR3C2 P08235 16/20 0.62
PGR P06401 10/20 0.61

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
SCHEMBL291665 0.88 NR3C1 (1.00) NR3C1NR3C2PGR
SCHEMBL4446023 0.86 NR3C1 (0.59) NR3C1NR3C2PGR
SCHEMBL3651745 0.85 NR3C1 (0.81) NR3C1NR3C2PGR
SCHEMBL3945714 0.84 NR3C1 (0.61) NR3C1NR3C2PGR
SCHEMBL3687823 0.83 NR3C1 (0.78) NR3C1NR3C2PGR
SCHEMBL3952276 0.82 NR3C1 (0.64) NR3C1NR3C2PGR
SCHEMBL1932600 0.80 NR3C1 (0.76) NR3C1NR3C2PGR
SCHEMBL10089058 0.79 NR3C1 (0.85) NR3C1NR3C2PGR
SCHEMBL379514 0.77 NR3C1 (1.00) NR3C1NR3C2PGR
SCHEMBL6387448 0.77 NR3C1 (1.00) 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 4 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
EP-2051710-A2 COMPOSITIONS AND METHODS FOR TREATING, REDUCING, AMELIORATING, OR ALLEVIATING POSTERIOR-SEGMENT OPHTHALMIC DISEASES Bausch & Lomb Incorporated (US) 2009-04-29 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
WO-2008021729-A2 COMPOSITIONS AND METHODS FOR TREATING, REDUCING, AMELIORATING, OR ALLEVIATING POSTERIOR-SEGMENT OPHTHALMIC DISEASES BAUSCH & LOMB INCORPORATED (US) 2008-02-21 WO disclosed