SCHEMBL7843948

SCHEMBL7843948

CC(C)(C)OC(=O)N1CCCC(Cn2cc(C3=C(O)C(=O)NC3=O)c3ccccc32)C1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PRKACA P17612 2/20 0.54
PRKACG P22612 2/20 0.54
PRKACB P22694 2/20 0.54
PRKCB P05771 3/20 0.52
PRKCG P05129 2/20 0.52
PRKCA P17252 2/20 0.52
PRKCH P24723 2/20 0.52
PRKCE Q02156 2/20 0.52
PRKCD Q05655 2/20 0.52
HTR6 P50406 4/20 0.46
BCHE P06276 2/20 0.46
FEN1 P39748 1/20 0.44
KDM1A O60341 1/20 0.43
CAMK2D Q13557 3/20 0.42
ACKR3 P25106 1/20 0.42
SIRT2 Q8IXJ6 1/20 0.42
SRC P12931 1/20 0.40
PRKCZ Q05513 1/20 0.40
PDE4A P27815 1/20 0.40
PDE4B Q07343 1/20 0.40

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
SCHEMBL7843953 0.88 PRKCB (0.52) PRKACAPRKACGPRKACBPRKCBPRKCG
SCHEMBL7832859 0.83 HTR6 (0.46) PRKACAPRKACGPRKACBPRKCBPRKCG
SCHEMBL7842723 0.77 HTR6 (0.49) HTR6BCHEFEN1KDM1AACKR3
SCHEMBL23871348 0.72 ACKR3 (0.51) HTR6BCHEFEN1KDM1AACKR3
SCHEMBL21605864 0.72 ACKR3 (0.51) HTR6BCHEFEN1KDM1AACKR3
SCHEMBL29244762 0.72 ACKR3 (0.51) HTR6BCHEFEN1KDM1AACKR3
SCHEMBL13047247 0.71 FEN1 (0.47) HTR6BCHEFEN1KDM1AACKR3
SCHEMBL2997356 0.71 FEN1 (0.47) HTR6BCHEFEN1KDM1AACKR3
SCHEMBL13047240 0.71 FEN1 (0.47) HTR6BCHEFEN1KDM1AACKR3
SCHEMBL31302652 0.71 EPHX1 (0.54) HTR6BCHEFEN1KDM1AACKR3

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
EP-1120414-A1 DISUBSTITUTED MALEIMIDE COMPOUNDS AND MEDICINAL UTILIZATION THEREOF JAPAN TOBACCO INC. (JP) 2001-08-01 EP disclosed