SCHEMBL6558634

SCHEMBL6558634

CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2ccccc2I)cc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.46
APP P05067 2/20 0.45
TSHR P16473 4/20 0.42
TDP1 Q9NUW8 4/20 0.42
L3MBTL1 Q9Y468 3/20 0.42
MAPK1 P28482 3/20 0.42
MAPT P10636 2/20 0.42
CYP3A4 P08684 2/20 0.42
CYP1A2 P05177 1/20 0.42
PHLPP2 Q6ZVD8 1/20 0.42
ALDH1A1 P00352 9/20 0.41
HSD17B10 Q99714 2/20 0.41
ALOX15 P16050 2/20 0.41
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
USP2 O75604 1/20 0.39
SMN1; SMN2 Q16637 1/20 0.39
GAA P10253 2/20 0.38
NQO1 P15559 1/20 0.38
RELA Q04206 1/20 0.37

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
SCHEMBL3893906 0.79 SLC2A1 (0.47) SLC2A1TSHRTDP1L3MBTL1MAPK1
SCHEMBL6558649 0.78 SLC2A1 (0.46) SLC2A1TSHRTDP1L3MBTL1MAPK1
SCHEMBL6557998 0.78 SLC2A1 (0.46) SLC2A1TSHRTDP1L3MBTL1MAPK1
SCHEMBL13649911 0.78 SLC2A1 (0.46) SLC2A1TSHRTDP1L3MBTL1MAPK1
SCHEMBL2391501 0.78 SLC2A1 (0.46) SLC2A1APPTSHRTDP1L3MBTL1
SCHEMBL16632474 0.78 SLC6A2 (0.41) TSHRTDP1L3MBTL1MAPTALDH1A1
SCHEMBL6559034 0.76 SLC2A1 (0.58) SLC2A1TSHRTDP1L3MBTL1MAPK1
SCHEMBL10349727 0.76 SLC2A1 (0.49) SLC2A1TSHRTDP1L3MBTL1MAPK1
SCHEMBL7110610 0.76 SLC2A1 (0.61) SLC2A1TSHRTDP1L3MBTL1MAPK1
SCHEMBL61350 0.76 SLC2A1 (0.61) SLC2A1TSHRTDP1L3MBTL1MAPK1

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
EP-1100483-B1 GLUCOCORTICOID-SELECTIVE ANTI-INFLAMMATORY AGENTS ABBOTT LAB (US) 2004-09-29 EP claimed
US-6166013-A Glucocortiocoid-selective agents ABBOTT LABORATORIES (US) 2000-12-26 US disclosed