SCHEMBL28763239

SCHEMBL28763239

CC(C)OC(=O)CCCCO[C]=O

nearest known ligand 0.56

Predicted protein targets (top 19)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
ALDH1A1 P00352 3/20 0.38
GAA P10253 1/20 0.38
EPHX2 P34913 1/20 0.38
MAPT P10636 4/20 0.37
MAPK1 P28482 1/20 0.37
ALOX15 P16050 1/20 0.34
CASP1 P29466 1/20 0.34
CASP7 P55210 1/20 0.34
HSD17B10 Q99714 1/20 0.34
TSHR P16473 2/20 0.33
DGKA P23743 1/20 0.33
PRKCA P17252 1/20 0.33
PRKCE Q02156 1/20 0.33
PRKCQ Q04759 1/20 0.33
PRKCD Q05655 1/20 0.33
PDE3B Q13370 1/20 0.32
PDE3A Q14432 1/20 0.32
P2RY12 Q9H244 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
SCHEMBL28671155 0.84 LMNA (0.43) LMNAALDH1A1EPHX2MAPTMAPK1
SCHEMBL15391 0.82 LMNA (0.78) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL8104259 0.82 LMNA (0.78) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL494007 0.80 LMNA (0.83) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL10788600 0.80 LMNA (0.83) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL9216453 0.80 LMNA (0.83) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL495050 0.80 LMNA (0.83) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL494255 0.80 LMNA (0.83) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL494127 0.80 LMNA (0.83) LMNAALDH1A1GAAEPHX2MAPT
SCHEMBL495594 0.80 LMNA (0.83) LMNAALDH1A1GAAEPHX2MAPT

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
CN-114616291-A Resin composition, compound (Z), optical filter, and use of optical filter JSR株式会社 2022-06-10 CN disclosed