SCHEMBL6558657

SCHEMBL6558657

CN(C)c1ccc(C(c2ccc(N(C)C)cc2)c2cccc(Cl)c2)cc1

nearest known ligand 0.49

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
SLC2A1 P11166 1/20 0.49
MAPT P10636 3/20 0.45
TSHR P16473 3/20 0.45
L3MBTL1 Q9Y468 2/20 0.45
LMNA P02545 2/20 0.45
MEN1 O00255 1/20 0.45
NPC1 O15118 1/20 0.45
TP53 P04637 1/20 0.45
NFKB1 P19838 1/20 0.45
RAB9A P51151 1/20 0.45
NFKB2 Q00653 1/20 0.45
KMT2A Q03164 1/20 0.45
RELA Q04206 1/20 0.45
SMN1; SMN2 Q16637 1/20 0.45
NOX1 Q9Y5S8 1/20 0.45
TDP1 Q9NUW8 2/20 0.45
CYP1A2 P05177 1/20 0.45
CYP3A4 P08684 1/20 0.45
MAPK1 P28482 1/20 0.45
PHLPP2 Q6ZVD8 1/20 0.45

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
SCHEMBL22278542 0.83 SLC2A1 (0.53) SLC2A1MAPTTSHRL3MBTL1LMNA
SCHEMBL5011743 0.81 SLC2A1 (0.59) SLC2A1MAPTTSHRL3MBTL1MEN1
SCHEMBL4088685 0.80 ACP3 (0.48) TSHRMEN1KMT2AAOC3ALDH1A1
SCHEMBL7536675 0.79 KMT2A (0.51) SLC2A1MAPTTSHRL3MBTL1NPC1
SCHEMBL7110610 0.78 SLC2A1 (0.61) SLC2A1MAPTTSHRL3MBTL1MEN1
SCHEMBL61350 0.78 SLC2A1 (0.61) SLC2A1MAPTTSHRL3MBTL1MEN1
SCHEMBL61574 0.78 SLC2A1 (0.71) SLC2A1MAPTTSHRL3MBTL1MEN1
SCHEMBL9626237 0.78 SLC2A1 (0.71) SLC2A1MAPTTSHRL3MBTL1MEN1
Water SCHEMBL10498815 0.77 SLC2A1 (0.59) SLC2A1MAPTTSHRL3MBTL1MEN1
SCHEMBL11595893 0.76 NSD2 (0.44) SLC2A1MAPTTSHRL3MBTL1LMNA

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