SCHEMBL290972

SCHEMBL290972

CC(C)(CC(O)(CF)Cc1cc2ccc(C(N)=O)cc2[nH]1)c1cc(F)ccc1O

nearest known ligand 0.52

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.52
PGR P06401 13/20 0.52
NR3C2 P08235 13/20 0.52
CYP3A4 P08684 6/20 0.45
IL6 P05231 1/20 0.41
CYP2D6 P10635 1/20 0.41
CYP2C9 P11712 1/20 0.41
CYP2C19 P33261 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
SCHEMBL447415 0.89 NR3C1 (0.66) NR3C1PGRNR3C2CYP3A4IL6
SCHEMBL292122 0.80 NR3C1 (0.67) NR3C1PGRNR3C2CYP3A4
SCHEMBL27754122 0.79 NR3C1 (0.57) NR3C1PGRNR3C2CYP3A4
SCHEMBL292779 0.78 NR3C1 (0.64) NR3C1PGRNR3C2CYP3A4
SCHEMBL1635587 0.78 NR3C1 (0.65) NR3C1PGRNR3C2CYP3A4
SCHEMBL1931038 0.77 NR3C1 (0.52) NR3C1PGRNR3C2CYP3A4IL6
SCHEMBL293443 0.77 NR3C1 (0.81) NR3C1PGRNR3C2CYP3A4
SCHEMBL5822914 0.76 NR3C1 (0.49) NR3C1PGRNR3C2CYP3A4
SCHEMBL27754151 0.75 NR3C1 (0.61) NR3C1PGRNR3C2CYP3A4
SCHEMBL292311 0.74 NR3C1 (0.59) NR3C1PGRNR3C2CYP3A4

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 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2049112-B1 TREATING INFECTIONS AND SEQUELAE THEREOF WITH COMBINED DISSOCIATED GLUCOCORTICOID RECEPTOR AGONISTS AND ANTI-INFECTIVE AGENTS BAUSCH & LOMB (US) 2012-03-14 EP disclosed