SCHEMBL6014306

SCHEMBL6014306

C=CC(=O)OC(COC(=O)C(=C)C)COc1ccc(C=Cc2ccc(N(c3ccc(C)cc3)c3ccc(C)cc3)cc2)cc1

nearest known ligand 0.39

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAOB P27338 2/20 0.39
APP P05067 4/20 0.37
PPARA Q07869 1/20 0.35
AR P10275 1/20 0.33
CTDSP1 Q9GZU7 1/20 0.33
PTPN1 P18031 1/20 0.32
POLB P06746 2/20 0.32
APEX1 P27695 1/20 0.32
HTT P42858 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MAPT P10636 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
PPARG P37231 1/20 0.32

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
SCHEMBL6014302 1.00 MAOB (0.39) MAOBAPPPPARAARCTDSP1
SCHEMBL13569415 0.94 CTDSP1 (0.35) MAOBAPPPPARACTDSP1TDP1
SCHEMBL13569404 0.92 AR (0.34) MAOBARPOLBAPEX1HTT
SCHEMBL13569468 0.91 MAOB (0.42) MAOBAPPPPARAARCTDSP1
SCHEMBL27745480 0.89 AR (0.40) MAOBARPOLBAPEX1HTT
SCHEMBL13569406 0.89 MAPT (0.35) PPARAARPOLBAPEX1HTT
SCHEMBL13569411 0.86 CHKA (0.34) ARPOLBAPEX1HTTTDP1
SCHEMBL13569412 0.85 FFAR1 (0.37) PPARAMEN1KMT2APPARG
SCHEMBL13569403 0.84 TSHR (0.36) ARPOLBAPEX1HTTTDP1
SCHEMBL13569417 0.84 MAPT (0.37) PPARAARPOLBAPEX1HTT

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
JP-2006316011-A ACRYLIC ESTER COMPOUND AND ACRYLIC ESTER COMPOUND MIXTURE RICOH CO LTD 2006-11-24 JP disclosed