SCHEMBL3684073

SCHEMBL3684073

CC(C)CC(O)(Cc1cc2ccnc(F)c2[nH]1)C(F)(F)F

nearest known ligand 0.42

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.42
NR3C2 P08235 13/20 0.42
PGR P06401 12/20 0.42
CYP3A4 P08684 5/20 0.41

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
SCHEMBL4037362 0.81 NR3C1 (0.57) NR3C1NR3C2PGRCYP3A4
SCHEMBL3825739 0.81 AAK1 (0.31) NR3C1NR3C2
SCHEMBL3714466 0.78 NR3C1 (0.65) NR3C1NR3C2PGRCYP3A4
SCHEMBL10313415 0.76 NR3C1 (0.69) NR3C1NR3C2PGRCYP3A4
SCHEMBL292335 0.76 NR3C1 (0.69) NR3C1NR3C2PGRCYP3A4
SCHEMBL3707341 0.76 NR3C1 (0.61) NR3C1NR3C2PGRCYP3A4
SCHEMBL3653908 0.75 NR3C1 (0.55) NR3C1NR3C2PGR
SCHEMBL450470 0.74 NR3C1 (0.73) NR3C1NR3C2PGRCYP3A4
SCHEMBL3948579 0.73 NR3C1 (0.61) NR3C1NR3C2PGRCYP3A4
SCHEMBL5801771 0.72 NR3C1 (0.47) 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 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