SCHEMBL8353049

SCHEMBL8353049

Cc1cccc(/C=C2\c3ccccc3CCc3ccsc32)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 1/20 0.45
PGR P06401 1/20 0.45
NR3C2 P08235 1/20 0.45
AR P10275 1/20 0.45
MAPT P10636 6/20 0.43
ALDH1A1 P00352 3/20 0.43
HTT P42858 3/20 0.43
KDM4E B2RXH2 2/20 0.43
HCRTR1 O43613 1/20 0.43
HPGD P15428 1/20 0.43
PIM1 P11309 1/20 0.39
PIM2 Q9P1W9 1/20 0.39
KMT2A Q03164 5/20 0.39
NPC1 O15118 3/20 0.39
RAB9A P51151 3/20 0.39
PKM P14618 2/20 0.39
SMN1; SMN2 Q16637 2/20 0.39
STAT3 P40763 1/20 0.39
STAT1 P42224 1/20 0.39
MEN1 O00255 4/20 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
SCHEMBL4172455 0.85 MAOB (0.46) NR3C1PGRNR3C2ARMAPT
SCHEMBL4172460 0.85 MAOB (0.46) NR3C1PGRNR3C2ARMAPT
SCHEMBL4155418 0.85 AR (0.58) NR3C1PGRNR3C2ARMAPT
SCHEMBL13802885 0.85 MIF (0.54) NR3C1PGRNR3C2ARMAPT
SCHEMBL8350579 0.85 NR3C1 (0.48) NR3C1PGRNR3C2ARMAPT
SCHEMBL13802908 0.85 NR3C1 (0.43) NR3C1PGRNR3C2ARMAPT
SCHEMBL14092367 0.85 NR3C1 (0.43) NR3C1PGRNR3C2ARMAPT
SCHEMBL14092364 0.79 NR3C1 (0.77) NR3C1PGRNR3C2ARMAPT
SCHEMBL13802915 0.79 NR3C1 (0.77) NR3C1PGRNR3C2ARMAPT
SCHEMBL13802918 0.79 NR3C1 (0.77) NR3C1PGRNR3C2ARMAPT

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
WO-2004052847-A2 TRICYCLIC STEROID HORMONE NUCLEAR RECEPTOR MODULATORS ELI LILLY AND COMPANY (US) 2004-06-24 WO disclosed