SCHEMBL3468562

SCHEMBL3468562

CC(C)Cc1cccc(OOC(C)(C)C)c1CC(C)C

nearest known ligand 0.42

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
GABRA1 P14867 1/20 0.42
GABRB2 P47870 1/20 0.42
ELANE P08246 1/20 0.32
ATM Q13315 1/20 0.32
L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL9515956 0.79 ATM (0.34) GABRA1GABRB2ATML3MBTL1
SCHEMBL5685706 0.76 GABRA1 (0.52) GABRA1GABRB2ELANEL3MBTL1
SCHEMBL20213778 0.75 GABRA1 (0.46) GABRA1GABRB2ELANE
SCHEMBL2743774 0.74 GABRA1 (0.62) GABRA1GABRB2ELANE
SCHEMBL11452874 0.72 GABRA1 (0.47) GABRA1GABRB2ELANE
SCHEMBL248039 0.72 GABRA1 (0.47) GABRA1GABRB2ELANEL3MBTL1
SCHEMBL578687 0.71 TSHR (0.33) GABRA1GABRB2
SCHEMBL248040 0.71 GABRA1 (0.46) GABRA1GABRB2ELANEL3MBTL1
SCHEMBL28742907 0.70 KDM4E (0.32)
SCHEMBL28422031 0.70 INPPL1 (0.47) GABRA1GABRB2ELANE

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
US-7645818-B2 Material compositions for reinforcing ionic polymer composites THE UNITED STATES OF AMERICA AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2010-01-12 US disclosed
US-20080004376-A1 Material compositions for reinforcing ionic polymer composites THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2008-01-03 US disclosed
US-20060094800-A1 Material compositions for reinforcing ionic polymer composites AGRICULTURE, UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF, THE 2006-05-04 US disclosed
WO-2006047651-A2 MATERIAL COMPOSITIONS FOR REINFORCING IONIC POLYMER COMPOSITES THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY OF AGRICULTURE (US) 2006-05-04 WO disclosed