SCHEMBL29678784

SCHEMBL29678784

COc1ccc(C(c2c[nH]c3ccccc23)S(=O)(=O)c2ccc(C)cc2)cc1

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
NR3C1 P04150 2/20 0.56
PGR P06401 1/20 0.56
NR3C2 P08235 1/20 0.56
AR P10275 1/20 0.56
GAA P10253 6/20 0.50
MGAM O43451 4/20 0.50
SI P14410 4/20 0.50
MGAM2 Q2M2H8 4/20 0.50
AHR P35869 1/20 0.49
MAPT P10636 5/20 0.47
SMN1; SMN2 Q16637 3/20 0.46
NPC1 O15118 1/20 0.46
ALDH1A1 P00352 1/20 0.46
LMNA P02545 1/20 0.46
RAB9A P51151 1/20 0.46
MMP2 P08253 2/20 0.42
MMP9 P14780 2/20 0.42
NPSR1 Q6W5P4 2/20 0.42
TP53 P04637 1/20 0.42
MEN1 O00255 2/20 0.41

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
SCHEMBL29678756 0.92 GAA (0.51) NR3C1PGRNR3C2ARGAA
SCHEMBL29678938 0.88 GAA (0.50) NR3C1PGRNR3C2ARGAA
SCHEMBL29678804 0.86 MAPT (0.49) NR3C1PGRNR3C2ARGAA
SCHEMBL29678752 0.84 MAPT (0.52) NR3C1PGRNR3C2ARGAA
SCHEMBL945682 0.80 NR3C1 (0.55) NR3C1PGRNR3C2ARGAA
SCHEMBL29678809 0.80 NR3C1 (0.46) NR3C1GAAMGAMSIMGAM2
SCHEMBL29679210 0.79 MAPT (0.51) NR3C1GAAMGAMSIMGAM2
SCHEMBL29678900 0.76 NR3C1 (0.46) NR3C1GAAMGAMSIMGAM2
SCHEMBL946518 0.75 MEN1 (0.52) NR3C1GAAMGAMSIMGAM2
SCHEMBL29678961 0.75 MAPT (0.45) NR3C1GAAMGAMSIMGAM2

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
WO-2022131722-A1 NOVEL INDOLE DERIVATIVE, METHOD FOR PREPARING SAME, AND COMPOSITION FOR IMPROVING COGNITIVE FUNCTIONS COMPRISING SAME (주)케이메디켐 2022-06-23 WO claimed
WO-2022131722-A1 NOVEL INDOLE DERIVATIVE, METHOD FOR PREPARING SAME, AND COMPOSITION FOR IMPROVING COGNITIVE FUNCTIONS COMPRISING SAME (주)케이메디켐 2022-06-23 WO disclosed