SCHEMBL4113805

SCHEMBL4113805

CCOC(=O)N(C)c1ccc(-c2nc(C(Cl)(Cl)Cl)nc(C(Cl)(Cl)Cl)n2)c(Br)c1

nearest known ligand 0.41

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.41
TSHR P16473 1/20 0.39
KDM4E B2RXH2 1/20 0.37
PKM P14618 1/20 0.37
AGPAT2 O15120 1/20 0.33
MAPKAPK2 P49137 1/20 0.33
CHRNB2 P17787 1/20 0.31
CHRNB4 P30926 1/20 0.31
CHRNA3 P32297 1/20 0.31
CHRNA4 P43681 1/20 0.31
SIRT2 Q8IXJ6 1/20 0.31
SIRT1 Q96EB6 1/20 0.31
GAA P10253 1/20 0.30
MAPK1 P28482 1/20 0.30
NR1H3 Q13133 1/20 0.30
SMN1; SMN2 Q16637 1/20 0.30
GPBAR1 Q8TDU6 1/20 0.30
CTDSP1 Q9GZU7 1/20 0.30
HTT P42858 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
SCHEMBL946487 0.90 LMNA (0.35) LMNATSHRKDM4EPKMCTDSP1
SCHEMBL393364 0.83 AR (0.36) LMNAKDM4EPKMGAASMN1; SMN2
SCHEMBL15476094 0.80 LMNA (0.32) LMNAKDM4EPKM
SCHEMBL29860152 0.77 KDM4E (0.40) LMNATSHRKDM4EPKMGAA
SCHEMBL4535410 0.76 F2R (0.44) LMNAKDM4EAGPAT2MAPK1SMN1; SMN2
SCHEMBL4535411 0.76
SCHEMBL14597491 0.75
SCHEMBL393007 0.75 POLB (0.43) LMNAKDM4EPKMGAASMN1; SMN2
SCHEMBL15812782 0.75
SCHEMBL27951127 0.75 NPC1 (0.47) LMNAKDM4EGAASMN1; SMN2

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
US-20090051278-A1 ORGANIC ELECTROLUMINESCENT DISPLAY DEVICE HAVING SCATTERING MEMBER FUJIFILM CORPORATION (JP) 2009-02-26 US disclosed