SCHEMBL27667482

SCHEMBL27667482

COc1ccc(F)cc1C(C)(CF)CC(C)=O

nearest known ligand 0.46

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 19/20 0.46
NR3C2 P08235 11/20 0.46
PGR P06401 1/20 0.44

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
SCHEMBL5203359 0.88 NR3C1 (0.46) NR3C1NR3C2
SCHEMBL1634784 0.85 NR3C2 (0.53) NR3C1NR3C2
SCHEMBL6639450 0.80 HTR2C (0.43) NR3C1NR3C2
SCHEMBL13823431 0.79 NR3C2 (0.50) NR3C1NR3C2
SCHEMBL27813424 0.78 DDR1 (0.37)
SCHEMBL27686485 0.78 RIPK1 (0.34) NR3C1NR3C2PGR
SCHEMBL4490249 0.77 NR3C2 (0.51) NR3C1NR3C2
SCHEMBL3889197 0.76 NR3C2 (0.53) NR3C1NR3C2PGR
SCHEMBL1492607 0.76 NR3C2 (0.53) NR3C1NR3C2
SCHEMBL10313421 0.76 NR3C2 (0.50) NR3C1NR3C2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-1976705-B 1,1, 1-trifluoro-4-phenyl-4-methyl-2- (1H-pyrrolo [2,3-C ] pyridin-2-ylmethyl) pentan-2-ol derivatives and related compounds as glucocorticoid ligands for the treatment of inflammatory diseases and diabetes BOEHRINGER INGELHEIM PHARMA 2010-09-22 CN disclosed
CN-1976705-A 1,1, 1-trifluoro-4-phenyl-4-methyl-2- (1H-pyrrolo [2, 3-C ] pyridin-2-ylmethyl) pentan-2-ol derivatives and related compounds as glucocorticoid ligands for the treatment of inflammatory diseases and diabetes BOEHRINGER INGELHEIM PHARMA (US) 2007-06-06 CN disclosed