SCHEMBL4947996

SCHEMBL4947996

CC=C1CCCCOC1=O

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.44
CA9 Q16790 1/20 0.44
DYRK1A Q13627 4/20 0.44
DYRK1B Q9Y463 4/20 0.44
CLK1 P49759 2/20 0.44
NAMPT P43490 1/20 0.43
MAPT P10636 3/20 0.39
ALDH1A1 P00352 1/20 0.37
KMT2A Q03164 1/20 0.34
HSP90AA1 P07900 1/20 0.34
HSP90AB1 P08238 1/20 0.34
KDM4E B2RXH2 1/20 0.33
ATM Q13315 1/20 0.33
PGR P06401 2/20 0.33
ALOX5 P09917 1/20 0.33
PTGS1 P23219 1/20 0.33
PTGS2 P35354 1/20 0.33
GAA P10253 1/20 0.33
MAPK1 P28482 1/20 0.33
DYRK2 Q92630 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
SCHEMBL980488 0.93
SCHEMBL12374717 0.84
SCHEMBL9771306 0.84
SCHEMBL979637 0.84
SCHEMBL9686981 0.71
SCHEMBL9686986 0.71
SCHEMBL4950825 0.71 ALDH1A1 (0.77) DYRK1ADYRK1BCLK1NAMPTMAPT
SCHEMBL7737903 0.70
SCHEMBL14972809 0.70 NAMPT (0.47) CA1CA9DYRK1ADYRK1BCLK1
SCHEMBL30881494 0.70 NAMPT (0.47) CA1CA9DYRK1ADYRK1BCLK1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-100563056-C Lithium secondary battery MITSUBISHI CHEM CORP (JP) 2009-11-25 CN disclosed
US-20080311478-A1 Lithium Secondary Battery MITSUBISHI CHEMICAL CORPORATION (JP) 2008-12-18 US disclosed
CN-101203982-A Lithium secondary battery MITSUBISHI CHEM CORP (JP) 2008-06-18 CN disclosed
EP-1892789-A1 LITHIUM SECONDARY BATTERY Mitsubishi Chemical Corporation (JP) 2008-02-27 EP disclosed