SCHEMBL981606

SCHEMBL981606

CC=C1CCC(C)OC1=O

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA1 P00915 1/20 0.50
CA9 Q16790 1/20 0.50
DYRK1A Q13627 3/20 0.36
DYRK1B Q9Y463 3/20 0.36
CLK1 P49759 2/20 0.36
HPGD P15428 1/20 0.35
SMN1; SMN2 Q16637 4/20 0.34
PIK3CA P42336 1/20 0.34
DYRK2 Q92630 1/20 0.34
LMNA P02545 3/20 0.31
ESR2 Q92731 3/20 0.31
ALDH1A1 P00352 2/20 0.31
HSP90AA1 P07900 2/20 0.31
HSP90AB1 P08238 2/20 0.31
POLB P06746 2/20 0.31
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
MAOA P21397 1/20 0.30
NR1I2 O75469 1/20 0.30
TP53 P04637 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
SCHEMBL19904768 1.00 CA1 (0.50) CA1CA9DYRK1ADYRK1BCLK1
SCHEMBL21244821 0.82 CA1 (0.48) CA1CA9DYRK1ADYRK1BCLK1
SCHEMBL663387 0.78
SCHEMBL980374 0.78
SCHEMBL1904974 0.78
SCHEMBL23846295 0.78 CA1 (0.30) CA1CA9
SCHEMBL25097702 0.75
SCHEMBL25097706 0.75
SCHEMBL7807181 0.75
SCHEMBL23846292 0.75 CYP1A2 (0.40) HPGDSMN1; SMN2LMNAMAOA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20110014504-A1 LITHIUM SECONDARY BATTERY MITSUBISHI CHEMICAL CORPORATION (JP) 2011-01-20 US disclosed
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