SCHEMBL4438484

SCHEMBL4438484

CC(c1ccc(F)cc1F)(c1c[nH]c2c(CS(C)(=O)=O)cc(F)cc12)C1CC1

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 5/20 0.61
PGR P06401 5/20 0.61
NR3C2 P08235 5/20 0.61
AR P10275 5/20 0.61
BRD4 O60885 1/20 0.32
BRD2 P25440 1/20 0.32
BRD3 Q15059 1/20 0.32
BRDT Q58F21 1/20 0.32
GPR84 Q9NQS5 1/20 0.32
MPO P05164 2/20 0.31
SLC6A4 P31645 2/20 0.31
APOL1 O14791 1/20 0.31
BCHE P06276 1/20 0.30
HTR6 P50406 2/20 0.30
DPP4 P27487 1/20 0.30
DPP8 Q6V1X1 1/20 0.30
DPP9 Q86TI2 1/20 0.30
DPP7 Q9UHL4 1/20 0.30

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
SCHEMBL1348797 0.91 NR3C1 (0.52) NR3C1PGRNR3C2AR
SCHEMBL1350412 0.89 NR3C1 (0.71) NR3C1PGRNR3C2ARBRD4
SCHEMBL1349777 0.85 NR3C1 (0.45) NR3C1PGRNR3C2ARBRD4
SCHEMBL1426794 0.83 NR3C1 (0.51) NR3C1PGRNR3C2AR
SCHEMBL1350367 0.80 NR3C1 (0.58) NR3C1PGRNR3C2ARHTR6
SCHEMBL1349075 0.79 NR3C1 (0.58) NR3C1PGRNR3C2ARSLC6A4
SCHEMBL8329009 0.76 NR3C1 (1.00) NR3C1PGRNR3C2AR
SCHEMBL8327350 0.76 NR3C1 (1.00) NR3C1PGRNR3C2AR
SCHEMBL29814832 0.76 NR3C1 (1.00) NR3C1PGRNR3C2AR
SCHEMBL1349908 0.76 NR3C1 (0.70) NR3C1PGRNR3C2ARHTR6

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-2009156072-A1 SUBSTITUTED 7-SULFANYLMETHYL, 7-SULFINYLMETHYL AND 7-SULFONYLMETHYL INDOLES AND USE THEREOF BAYER SCHERING PHARMA AKTIENGESELLSCHAFT (DE) 2009-12-30 WO disclosed