SCHEMBL246725

SCHEMBL246725

CC=CC(=O)OCCC1CCO1

nearest known ligand 0.35

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
ATM Q13315 1/20 0.35
EPHX1 P07099 1/20 0.34
GSTP1 P09211 1/20 0.34
HCAR2 Q8TDS4 4/20 0.33
ALDH1A1 P00352 3/20 0.33
MGLL Q99685 1/20 0.33
LMNA P02545 2/20 0.32
POLB P06746 1/20 0.32
THRB P10828 1/20 0.31
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
SCHEMBL27934787 0.86 ATM (0.37) ATMGSTP1HCAR2ALDH1A1MGLL
SCHEMBL247370 0.83 MGLL (0.45) GSTP1ALDH1A1MGLLLMNAPOLB
SCHEMBL28035371 0.82 SLC6A2 (0.34) ATMGSTP1HCAR2MGLL
SCHEMBL156554 0.80 EPHX1 (0.34) EPHX1ALDH1A1LMNAPOLBL3MBTL1
SCHEMBL1355144 0.79 TSHR (0.47) EPHX1ALDH1A1LMNAPOLBTHRB
SCHEMBL27845562 0.78 ATM (0.44) ATMGSTP1HCAR2ALDH1A1MGLL
SCHEMBL2274083 0.76 EPHX1 (0.35) EPHX1
SCHEMBL1069285 0.75 LMNA (0.55) ALDH1A1MGLLLMNAPOLB
SCHEMBL1069284 0.75 LMNA (0.55) ALDH1A1MGLLLMNAPOLB
SCHEMBL28044349 0.75 ATM (0.39) ATMGSTP1HCAR2ALDH1A1LMNA

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
US-20120002138-A1 Pattern forming ink composition, light guide plate, light emitting unit and liquid crystal display element having the light emitting unit CHI-MEI CORPORATION 2012-01-05 US disclosed