SCHEMBL6556701

SCHEMBL6556701

COC(=O)Nc1ccc(Cl)c(C(c2ccc(N(C)C)cc2)c2ccc(N(C)C)cc2)c1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 9/20 0.43
NPC1 O15118 5/20 0.43
RAB9A P51151 5/20 0.43
SMN1; SMN2 Q16637 5/20 0.43
KMT2A Q03164 4/20 0.43
MEN1 O00255 3/20 0.43
TP53 P04637 3/20 0.43
NOX1 Q9Y5S8 2/20 0.43
LMNA P02545 1/20 0.43
TSHR P16473 1/20 0.43
NFKB1 P19838 1/20 0.43
NFKB2 Q00653 1/20 0.43
RELA Q04206 1/20 0.43
L3MBTL1 Q9Y468 1/20 0.43
ALDH1A1 P00352 5/20 0.42
KDM4E B2RXH2 2/20 0.42
THRB P10828 1/20 0.42
GFER P55789 1/20 0.42
TDP1 Q9NUW8 1/20 0.42
HPGD P15428 3/20 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
SCHEMBL6556719 0.87 ALDH1A1 (0.47) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL6556741 0.77 MAPT (0.59) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL6557047 0.76 SLC2A1 (0.46) MAPTSMN1; SMN2KMT2AMEN1TP53
SCHEMBL10118253 0.76 MAPT (0.68) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL6558728 0.73 ALDH1A1 (0.43) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL6556759 0.73 TRPV1 (0.52) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL116096 0.71 EPHX1 (0.66) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL4894719 0.71 EPHX1 (0.66) MAPTNPC1RAB9ASMN1; SMN2KMT2A
SCHEMBL6558698 0.71 SLC2A1 (0.41) MAPTNPC1SMN1; SMN2KMT2AMEN1
SCHEMBL6556784 0.71 ALDH1A1 (0.47) MAPTNPC1RAB9ASMN1; SMN2KMT2A

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