SCHEMBL8324764

SCHEMBL8324764

CCC(CC)(c1cc2c(C(F)(F)F)cccc2s1)c1c[nH]c2c(NS(C)(=O)=O)cccc12

nearest known ligand 0.45

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 12/20 0.45
PGR P06401 10/20 0.45
NR3C2 P08235 10/20 0.45
AR P10275 10/20 0.45
SLC9A1 P19634 2/20 0.42
PLA2G7 Q13093 5/20 0.42
SLC22A12 Q96S37 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
SCHEMBL8322122 0.90 NR3C1 (0.51) NR3C1PGRNR3C2ARSLC9A1
SCHEMBL6089111 0.86 NR3C1 (0.46) NR3C1PGRNR3C2ARPLA2G7
SCHEMBL6090802 0.85 NR3C1 (0.48) NR3C1PGRNR3C2ARPLA2G7
SCHEMBL6091219 0.84 NR3C1 (0.47) NR3C1PGRNR3C2ARPLA2G7
SCHEMBL6090475 0.83 NR3C1 (0.54) NR3C1PGRNR3C2ARPLA2G7
SCHEMBL8324769 0.80 NR3C1 (0.49) NR3C1PGRNR3C2ARPLA2G7
SCHEMBL6092179 0.80 NR3C2 (0.49) NR3C1PGRNR3C2AR
SCHEMBL6090093 0.80 NR3C2 (0.56) NR3C1PGRNR3C2ARPLA2G7
SCHEMBL6089588 0.79 NR3C1 (0.48) NR3C1PGRNR3C2ARPLA2G7
SCHEMBL6091677 0.78 NR3C1 (0.53) NR3C1PGRNR3C2ARPLA2G7

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-2004067529-A1 INDOLE-DERIVATIVE MODULATORS OF STEROID HORMONE NUCLEAR RECEPTORS ELI LILLY AND COMPANY (US) 2004-08-12 WO disclosed