SCHEMBL2499290

SCHEMBL2499290

Fc1ccc(-n2ncc3cc(I)ccc32)cc1.In1ncc2ccccc21

nearest known ligand 0.56

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 17/20 0.56
PGR P06401 5/20 0.51
CYP11B2 P19099 1/20 0.45
SMO Q99835 1/20 0.45

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
SCHEMBL443024 0.87 NR3C1 (0.62) NR3C1PGRCYP11B2SMO
SCHEMBL29496849 0.81 NR3C1 (0.65) NR3C1PGRCYP11B2SMO
SCHEMBL1135795 0.81 NR3C1 (0.65) NR3C1PGRCYP11B2SMO
Bromide SCHEMBL10578970 0.80 NR3C1 (0.63) NR3C1PGRCYP11B2SMO
SCHEMBL25044243 0.77 NOS1 (0.38) CYP11B2
SCHEMBL2499293 0.76 NR3C1 (0.51) NR3C1PGRCYP11B2SMO
SCHEMBL5135413 0.75 CYP11B2 (0.71) NR3C1PGRCYP11B2
SCHEMBL836802 0.73 NPC1 (0.48) NR3C1PGRCYP11B2SMO
SCHEMBL30918005 0.72 CYP11B2 (0.72) NR3C1PGRCYP11B2SMO
SCHEMBL787026 0.72 RECQL (0.47) CYP11B2

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
US-8030340-B2 Moderators of glucocorticoids receptor; antiinflamamtory agents; chronic obstructive pulmonary disease ASTRAZENECA AB (SE) 2011-10-04 US disclosed