SCHEMBL28008652

SCHEMBL28008652

CCOC(CC)C(=O)Oc1ccccc1

nearest known ligand 0.46

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
L3MBTL1 Q9Y468 2/20 0.46
ATM Q13315 1/20 0.46
MAPT P10636 1/20 0.45
PPARA Q07869 8/20 0.45
PPARG P37231 6/20 0.45
PPARD Q03181 4/20 0.45
CYP1A2 P05177 1/20 0.44
TSHR P16473 1/20 0.43
TDP1 Q9NUW8 1/20 0.43
ELANE P08246 1/20 0.42
ALDH1A1 P00352 2/20 0.40
PIN1 Q13526 1/20 0.40
HPGD P15428 2/20 0.40
NPC1 O15118 1/20 0.40
CRHBP P24387 1/20 0.40
RAB9A P51151 1/20 0.40
CRHR2 Q13324 1/20 0.40
LMNA P02545 1/20 0.39
MEN1 O00255 1/20 0.39
KMT2A Q03164 1/20 0.39

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
SCHEMBL28008251 0.87 PPARA (0.47) L3MBTL1ATMMAPTPPARAPPARG
SCHEMBL28095822 0.85 L3MBTL1 (0.43) L3MBTL1ATMMAPTPPARAPPARG
SCHEMBL28008693 0.85 PPARA (0.54) PPARAPPARGPPARD
SCHEMBL28598689 0.85 ELANE (0.43) L3MBTL1ATMMAPTPPARAPPARG
SCHEMBL16673133 0.85 ALDH1A1 (0.46) L3MBTL1ATMPPARAPPARGPPARD
SCHEMBL18651711 0.84 TSHR (0.48) L3MBTL1ATMMAPTPPARAPPARG
SCHEMBL16672960 0.84 TSHR (0.55) L3MBTL1ATMPPARAPPARGCYP1A2
SCHEMBL28008679 0.84 TDP1 (0.46) L3MBTL1ATMMAPTPPARAPPARG
SCHEMBL8669698 0.83 ATM (0.41) L3MBTL1ATMMAPTPPARAPPARG
SCHEMBL28090512 0.81 ATM (0.45) L3MBTL1ATMMAPTCYP1A2TSHR

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-104412441-A Nonaqueous electrolyte solution and nonaqueous electrolyte battery using same MITSUBISHI CHEM CORP 2015-03-11 CN disclosed