SCHEMBL10313445

SCHEMBL10313445

CC(C)(CC(=O)C(F)(F)F)c1cc(F)ccc1O

nearest known ligand 0.44

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 15/20 0.44
PGR P06401 10/20 0.44
NR3C2 P08235 9/20 0.44
PLOD2 O00469 1/20 0.39
AR P10275 1/20 0.39
P2RX1 P51575 1/20 0.35
TMPRSS4 Q9NRS4 1/20 0.35
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34

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
SCHEMBL379406 0.84 NR3C1 (0.48) NR3C1PGRNR3C2PLOD2
SCHEMBL1492523 0.83 PLOD2 (0.38) NR3C1PGRNR3C2PLOD2
SCHEMBL1492567 0.81 HDAC6 (0.40) NR3C1PGRNR3C2PLOD2
SCHEMBL1492624 0.81 DDR1 (0.39) NR3C1PGRNR3C2PLOD2
SCHEMBL1492607 0.81 NR3C2 (0.53) NR3C1NR3C2
SCHEMBL1492525 0.81 DDR1 (0.40) NR3C1PLOD2
SCHEMBL1492608 0.80 PLOD2 (0.38) NR3C1PGRNR3C2PLOD2AR
SCHEMBL10254048 0.80 PLOD2 (0.38) NR3C1PGRNR3C2PLOD2
SCHEMBL14340600 0.80 RIPK1 (0.40) NR3C1PGRNR3C2PLOD2
SCHEMBL1492615 0.79 KEAP1 (0.42) NR3C1NR3C2PLOD2

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
US-8212040-B2 Glucocorticoid mimetics, methods of making them, pharmaceutical compositions, and thereof BOEHRINGER INGELHEIM PHARMACEUTICALS, INC. (US) 2012-07-03 US disclosed