SCHEMBL5202660

SCHEMBL5202660

COc1ccc(F)cc1C(C)(C)CC(O)(CNc1cccc2nc(OC(N)=O)ccc12)C(F)(F)F

nearest known ligand 0.75

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 20/20 0.75
PGR P06401 3/20 0.69
NR3C2 P08235 5/20 0.49

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
SCHEMBL5236963 0.93 NR3C1 (0.76) NR3C1PGRNR3C2
SCHEMBL5201148 0.91 NR3C1 (0.74) NR3C1PGRNR3C2
SCHEMBL3651686 0.91 NR3C1 (0.84) NR3C1PGRNR3C2
SCHEMBL5202057 0.90 NR3C1 (0.73) NR3C1PGRNR3C2
SCHEMBL5203704 0.89 NR3C1 (0.71) NR3C1PGRNR3C2
SCHEMBL3644333 0.89 NR3C1 (0.77) NR3C1PGRNR3C2
SCHEMBL5201950 0.89 NR3C1 (0.60) NR3C1PGRNR3C2
SCHEMBL3691867 0.88 NR3C1 (0.79) NR3C1PGRNR3C2
SCHEMBL4825644 0.87 NR3C1 (0.80) NR3C1PGRNR3C2
SCHEMBL4823363 0.87 NR3C1 (0.82) NR3C1PGRNR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1492771-B1 QUINOLINE AND ISOQUINOLINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS ANTI-INFLAMMATORY AGENTS SCHERING AG (DE) 2007-02-28 EP disclosed
EP-1492771-A1 QUINOLINE AND ISOQUINOLINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS ANTI-INFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 2005-01-05 EP disclosed
WO-2003082827-A1 QUINOLINE AND ISOQUINOLINE DERIVATIVES, METHOD FOR THE PRODUCTION THEREOF AND USE THEREOF AS ANTI-INFLAMMATORY AGENTS SCHERING AKTIENGESELLSCHAFT (DE) 2003-10-09 WO disclosed