SCHEMBL5740910

SCHEMBL5740910

CC(C)(CC(O)(Cc1ccccc1)C(=O)Nc1cc(C(F)(F)F)cc(C(F)(F)F)c1)c1cc(F)ccc1O

nearest known ligand 0.65

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 17/20 0.65
PGR P06401 16/20 0.65
NR3C2 P08235 8/20 0.65
P2RX1 P51575 1/20 0.46
TMPRSS4 Q9NRS4 1/20 0.46
AR P10275 1/20 0.43
CETP P11597 1/20 0.41
KCNH2 Q12809 1/20 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
SCHEMBL4617201 0.90 NR3C1 (0.71) NR3C1PGRNR3C2AR
SCHEMBL5744371 0.89 NR3C1 (0.68) NR3C1PGRNR3C2AR
SCHEMBL5742025 0.89 NR3C1 (0.68) NR3C1PGRNR3C2AR
SCHEMBL5741213 0.88 NR3C1 (0.66) NR3C1PGRNR3C2
SCHEMBL5742909 0.87 NR3C1 (0.66) NR3C1PGRNR3C2AR
SCHEMBL5740674 0.84 PGR (0.64) NR3C1PGRNR3C2AR
SCHEMBL292680 0.82 NR3C1 (0.62) NR3C1PGRNR3C2P2RX1TMPRSS4
SCHEMBL3657148 0.81 NR3C1 (0.59) NR3C1PGRNR3C2
SCHEMBL5742841 0.80 NR3C1 (0.66) NR3C1PGRNR3C2P2RX1TMPRSS4
SCHEMBL292961 0.79 PGR (1.00) 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-1467982-B1 GLUCOCORTICOID MIMETICS, METHODS OF MAKING THEM, PHARMACEUTICAL FORMULATIONS CONTAINING THEM, AND USES THEREOF BOEHRINGER INGELHEIM PHARMA (US) 2006-11-22 EP claimed
US-7189758-B2 Glucocorticoid mimetics, methods of making them, pharmaceutical formulations, and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-03-13 US disclosed
US-7189758-B2 Glucocorticoid mimetics, methods of making them, pharmaceutical formulations, and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2007-03-13 US disclosed
US-6960581-B2 Glucocorticoid mimetics, methods of making them, pharmaceutical formulations, and uses thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2005-11-01 US disclosed