SCHEMBL5034310

SCHEMBL5034310

COc1cc(F)ccc1-c1ccc2c(c1C(O)C(=O)c1sc(C)cc1C)C(C)=CC(C)(C)N2

nearest known ligand 0.41

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 10/20 0.41
PGR P06401 14/20 0.41
AR P10275 3/20 0.41
ESR1 P03372 1/20 0.41
ESR2 Q92731 1/20 0.41
NR3C2 P08235 1/20 0.38

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
SCHEMBL462616 0.84 PGR (0.49) NR3C1PGRARESR1ESR2
SCHEMBL2393953 0.83 NR3C1 (0.43) NR3C1PGRARESR1ESR2
SCHEMBL2393962 0.81 PGR (0.41) NR3C1PGRARESR1ESR2
SCHEMBL2391814 0.77 NR3C1 (0.49) NR3C1PGRARESR1ESR2
SCHEMBL2395852 0.76 PGR (0.44) NR3C1PGRARESR1ESR2
SCHEMBL5132462 0.75 PGR (0.47) NR3C1PGRARESR1ESR2
SCHEMBL5040811 0.75 NR3C1 (0.46) NR3C1PGRARESR1ESR2
SCHEMBL2395036 0.75 NR3C1 (0.48) NR3C1PGRARESR1ESR2
SCHEMBL2394873 0.75 PGR (0.45) NR3C1PGRARESR1ESR2
SCHEMBL2390393 0.74 NR3C1 (0.49) NR3C1PGRARESR1ESR2

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-1944290-A1 NOVEL 1-2-DIHYDROQUINOLINE DERIVATIVE HAVING GLUCOCORTICOID RECEPTOR BINDING ACTIVITY SANTEN PHARMACEUTICAL CO., LTD. (JP) 2008-07-16 EP disclosed