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SCHEMBL7842723

SCHEMBL7842723

CC(C)(C)OC(=O)N1CCCC(Cn2cc(CC(N)=O)c3ccccc32)C1

nearest known ligand 0.49

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ HTR6 P50406 6/20 0.49
▸ BCHE P06276 2/20 0.49
▸ ICMT O60725 7/20 0.47
▸ ACKR3 P25106 1/20 0.46
▸ KDM1A O60341 1/20 0.44
▸ FEN1 P39748 1/20 0.44
▸ EPHX1 P07099 1/20 0.43
▸ CNR1 P21554 1/20 0.42
▸ L3MBTL1 Q9Y468 1/20 0.42

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
SCHEMBL31302628 0.79 EPHX1 (0.54) HTR6BCHEACKR3KDM1AFEN1
SCHEMBL31302652 0.79 EPHX1 (0.54) HTR6BCHEACKR3KDM1AFEN1
SCHEMBL7843948 0.77 PRKACA (0.54) HTR6BCHEACKR3KDM1AFEN1
SCHEMBL1991648 0.77 L3MBTL1 (0.62) HTR6CNR1L3MBTL1
SCHEMBL1992845 0.76 CHRM2 (0.48) HTR6EPHX1
SCHEMBL1991929 0.76 ICMT (0.57) HTR6ICMTCNR1
SCHEMBL7832859 0.75 HTR6 (0.46) HTR6BCHEACKR3KDM1AFEN1
SCHEMBL7843953 0.74 PRKCB (0.52) HTR6BCHE
SCHEMBL30777140 0.73 L3MBTL1 (0.72) HTR6ICMTEPHX1L3MBTL1
SCHEMBL20284290 0.72 HTR6 (0.49) HTR6BCHEACKR3KDM1AFEN1

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