SCHEMBL28008277

SCHEMBL28008277

CCOC(C)(C(=O)Oc1ccccc1)C(C)C

nearest known ligand 0.43

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 12/20 0.43
L3MBTL1 Q9Y468 2/20 0.43
ATM Q13315 1/20 0.43
MAPT P10636 2/20 0.39
TDP1 Q9NUW8 2/20 0.37
NPC1 O15118 1/20 0.37
RAB9A P51151 1/20 0.37
MEN1 O00255 1/20 0.36
CYP1A2 P05177 1/20 0.36
CYP3A4 P08684 1/20 0.36
GAA P10253 1/20 0.36
CYP2D6 P10635 1/20 0.36
CYP2C9 P11712 1/20 0.36
CYP2C19 P33261 1/20 0.36
KMT2A Q03164 1/20 0.36
PRTN3 P24158 1/20 0.36
PIN1 Q13526 1/20 0.36

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
SCHEMBL28008719 0.88 ELANE (0.41) ELANEL3MBTL1ATMMAPTTDP1
SCHEMBL28008255 0.80 ELANE (0.47) ELANEL3MBTL1ATMMAPTTDP1
SCHEMBL7648282 0.80 ELANE (0.47) ELANEL3MBTL1ATMMAPTTDP1
SCHEMBL28008260 0.78 ELANE (0.49) ELANEL3MBTL1ATMMAPTTDP1
SCHEMBL28008337 0.77 ELANE (0.44) ELANEL3MBTL1ATMMAPTNPC1
SCHEMBL5326502 0.76 ELANE (0.50) ELANEL3MBTL1ATMMAPTTDP1
SCHEMBL16672754 0.76 ELANE (0.44) ELANEL3MBTL1ATMMAPTTDP1
SCHEMBL27256632 0.76 ELANE (0.42) ELANEL3MBTL1ATMMAPTTDP1
Ammonia Solution, Strong SCHEMBL28033407 0.75 ELANE (0.49) ELANEL3MBTL1ATMMAPTTDP1
SCHEMBL11780388 0.74 MAPT (0.44) ELANEL3MBTL1ATMMAPTTDP1

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