SCHEMBL27705778

SCHEMBL27705778

O=CC1C(O)C=CCCC1O

nearest known ligand 0.32

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
GSR P00390 1/20 0.32
CCNA2 P20248 3/20 0.30
CDK2 P24941 3/20 0.30
CCNA1 P78396 3/20 0.30
PLK4 O00444 2/20 0.30
CDK1 P06493 2/20 0.30
AXL P30530 2/20 0.30
FLT3 P36888 2/20 0.30
CDK5 Q00535 2/20 0.30
PRKCE Q02156 2/20 0.30
MKNK1 Q9BUB5 2/20 0.30
MKNK2 Q9HBH9 2/20 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
SCHEMBL27686541 0.77
SCHEMBL27840565 0.77
SCHEMBL1847661 0.76
SCHEMBL7520360 0.76
SCHEMBL5048591 0.76
SCHEMBL14011832 0.76
SCHEMBL7526717 0.76
SCHEMBL12199040 0.76
Bicarbonate SCHEMBL1010325 0.73 GSR (0.34) GSRCCNA2CDK2CCNA1PLK4
SCHEMBL27297231 0.66 MAPT (0.31)

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-101076916-A Nonaqueous electrolyte for secondary battery and secondary battery comprising same MATSUSHITA ELECTRIC INDUSTRIAL CO LTD (JP) 2007-11-21 CN disclosed