SCHEMBL3948012

SCHEMBL3948012

CC(O)(Cc1ccnc2ccccc12)CC(C)(c1cccc(F)c1)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 13/20 0.44
PGR P06401 4/20 0.40
NR3C2 P08235 4/20 0.39
LOXL2 Q9Y4K0 1/20 0.35
MDM4 O15151 1/20 0.34
TP53 P04637 1/20 0.34
MDM2 Q00987 1/20 0.34
FLT1 P17948 1/20 0.34
KDR P35968 1/20 0.34
EGFR P00533 1/20 0.34
ABCG2 Q9UNQ0 1/20 0.34
CYP1A2 P05177 1/20 0.34
GRM4 Q14833 1/20 0.34

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
SCHEMBL3684843 0.89 NR3C1 (0.41) NR3C1PGRNR3C2LOXL2FLT1
SCHEMBL6640065 0.86 NR3C1 (0.39) NR3C1PGRNR3C2KDREGFR
SCHEMBL291931 0.85 NR3C1 (0.52) NR3C1PGRNR3C2
SCHEMBL3655516 0.84 NR3C1 (0.44) NR3C1PGRNR3C2LOXL2FLT1
SCHEMBL3955241 0.84 NR3C1 (0.44) NR3C1LOXL2FLT1KDRABCG2
SCHEMBL3651952 0.83 NR3C1 (0.48) NR3C1PGRNR3C2
SCHEMBL4448777 0.80 NR3C1 (0.46) NR3C1PGRNR3C2LOXL2CYP1A2
SCHEMBL4427227 0.79 NR3C1 (0.43) NR3C1PGRNR3C2LOXL2CYP1A2
SCHEMBL1634229 0.77 NR3C1 (0.50) NR3C1PGRNR3C2LOXL2CYP1A2
SCHEMBL292747 0.75 NR3C1 (0.45) NR3C1PGRNR3C2

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-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-2008021729-A2 COMPOSITIONS AND METHODS FOR TREATING, REDUCING, AMELIORATING, OR ALLEVIATING POSTERIOR-SEGMENT OPHTHALMIC DISEASES BAUSCH & LOMB INCORPORATED (US) 2008-02-21 WO disclosed
EP-1673088-A1 1,1,1- TRIFLUORO-4-PHENYL-4-METHYL-2-(1H-PYRROLO¬2,3-C|PYRIDIN-2-YLMETHYL)PENTAN-2-OL DERIVATIVES AND RELATED COMPOUNDS AS GLUCOCORTICOID LIGANDS FOR THE TREATMENT OF INFLAMMATORY DISEASES AND DIABETES BOEHRINGER INGELHEIM PHARMACEUTICALS INC. (US) 2006-06-28 EP disclosed
WO-2005030213-A1 1,1,1-TRIFLUORO-4-PHENYL-4-METHYL-2-(1H-PYRROLO BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-04-07 WO disclosed