SCHEMBL28052059

SCHEMBL28052059

CC=C(C)CC(=O)CC(C)=CC

nearest known ligand 0.36

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.36
GAA P10253 1/20 0.36
SI P14410 1/20 0.36
MGAM2 Q2M2H8 1/20 0.36
KDM4E B2RXH2 2/20 0.32
KDM6B O15054 1/20 0.32
KDM5C P41229 1/20 0.32
EGLN1 Q9GZT9 1/20 0.32
PHF8 Q9UPP1 1/20 0.32
KDM2A Q9Y2K7 1/20 0.32
ALDH1A1 P00352 4/20 0.32
TDP1 Q9NUW8 2/20 0.32
CA2 P00918 1/20 0.32
PTGS1 P23219 1/20 0.32
MMP12 P39900 1/20 0.32
LMNA P02545 1/20 0.31
NFKB1 P19838 1/20 0.30
TRPA1 O75762 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
SCHEMBL6750265 0.85
SCHEMBL6750262 0.85
SCHEMBL1785020 0.80
SCHEMBL1785021 0.80
SCHEMBL5742287 0.79 SOAT1 (0.33) KDM4EKDM6BKDM5CEGLN1PHF8
SCHEMBL3616414 0.78
SCHEMBL3454057 0.78
SCHEMBL7207658 0.78
SCHEMBL3606097 0.78
SCHEMBL9815905 0.78

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-105837591-A Pharmaceutical composition of alfacalcidol and medical application of pharmaceutical composition 陈斌 2016-08-10 CN disclosed
CN-105481810-A Novel Fumu lactone compounds, and preparation method and medical application thereof WU JINFENG 2016-04-13 CN disclosed
CN-105418626-A New eremophilanolide compound as well as preparation method and medical application thereof Xining yige intellectual property consultation service co ltd 2016-03-23 CN disclosed