SCHEMBL9943316

SCHEMBL9943316

COc1cccc([C@@H](Oc2nn(-c3ccc(F)cc3)c3ccccc23)[C@H](C)NC(=O)C(=O)NC(C)(C)C)c1

nearest known ligand 0.54

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 19/20 0.54
PGR P06401 3/20 0.53
PTGS2 P35354 1/20 0.39

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
SCHEMBL835852 0.81 NR3C1 (0.81) NR3C1PGR
SCHEMBL834373 0.73 NR3C1 (0.82) NR3C1PGR
SCHEMBL9943361 0.72 NR3C1 (0.62) NR3C1PGR
SCHEMBL9943362 0.72 NR3C1 (0.62) NR3C1PGR
SCHEMBL835893 0.72 NR3C1 (0.81) NR3C1PGR
SCHEMBL850993 0.72 NR3C1 (0.81) NR3C1PGR
SCHEMBL836629 0.71 NR3C1 (0.82) NR3C1PGR
SCHEMBL836628 0.71 NR3C1 (0.82) NR3C1PGR
SCHEMBL851077 0.70 NR3C1 (0.91) NR3C1PGR
SCHEMBL835459 0.70 NR3C1 (0.91) NR3C1PGR

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-2102169-B1 INDAZOLYL AMIDE DERIVATIVES FOR THE TREATMENT OF GLUCOCORTICOID RECEPTOR MEDIATED DISORDERS ASTRAZENECA AB (SE) 2012-06-20 EP claimed