SCHEMBL5038555

SCHEMBL5038555

COc1ccc(Cl)cc1-c1ccc2c(c1C(N)c1ccccc1)C(C)=CC(C)(C)N2

nearest known ligand 0.46

Predicted protein targets (top 6)

geneUniProtsupporting neighboursconfidence
PGR P06401 15/20 0.46
NR3C1 P04150 12/20 0.46
AR P10275 6/20 0.46
NR3C2 P08235 3/20 0.46
ESR1 P03372 1/20 0.40
ESR2 Q92731 1/20 0.40

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
SCHEMBL2394018 0.88 NR3C1 (0.45) PGRNR3C1ARNR3C2ESR1
SCHEMBL5032360 0.83 PGR (0.49) PGRNR3C1ARNR3C2ESR1
SCHEMBL2393993 0.83 PGR (0.43) PGRNR3C1ARESR1ESR2
SCHEMBL2395442 0.80 NR3C1 (0.50) PGRNR3C1ARNR3C2ESR1
SCHEMBL2392500 0.78 KDM4E (0.46) PGRNR3C1ARNR3C2
SCHEMBL2398389 0.77 NR3C1 (0.49) PGRNR3C1ARNR3C2ESR1
SCHEMBL5035674 0.77 PGR (0.51) PGRNR3C1ARNR3C2
SCHEMBL2397746 0.76 PGR (0.46) PGRNR3C1ARNR3C2ESR1
SCHEMBL2394377 0.76 NR3C1 (0.45) PGRNR3C1ARNR3C2ESR1
SCHEMBL12236676 0.76 PGR (0.50) PGRNR3C1ARNR3C2

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