SCHEMBL28008337

SCHEMBL28008337

CCC(C(=O)Oc1ccccc1)(C(C)C)C(C)C

nearest known ligand 0.44

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
ELANE P08246 8/20 0.44
ATM Q13315 1/20 0.44
L3MBTL1 Q9Y468 1/20 0.44
NPC1 O15118 1/20 0.40
RAB9A P51151 1/20 0.40
CYP1A2 P05177 2/20 0.40
LMNA P02545 2/20 0.40
MAPT P10636 1/20 0.40
MEN1 O00255 1/20 0.40
ALDH1A1 P00352 1/20 0.40
TP53 P04637 1/20 0.40
GAA P10253 1/20 0.40
KMT2A Q03164 1/20 0.40
CYP2D6 P10635 1/20 0.40
CYP2C19 P33261 1/20 0.40
MTNR1A P48039 4/20 0.39
MTNR1B P49286 4/20 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
SCHEMBL3179425 0.79 ELANE (0.47) ELANEATML3MBTL1RAB9AMAPT
SCHEMBL8031952 0.79 ELANE (0.47) ELANEATML3MBTL1RAB9AMAPT
SCHEMBL28008714 0.79 ELANE (0.43) ELANEATML3MBTL1NPC1RAB9A
SCHEMBL27578403 0.79 ELANE (0.49) ELANEATML3MBTL1CYP1A2MAPT
Ammonia Solution, Strong SCHEMBL27373723 0.78 ELANE (0.46) ELANEATML3MBTL1RAB9AMAPT
SCHEMBL26453070 0.78 ELANE (0.50) ELANEATML3MBTL1MAPT
SCHEMBL7943217 0.78 ELANE (0.46) ELANEATML3MBTL1RAB9AMAPT
SCHEMBL9250267 0.78 ELANE (0.46) ELANEATML3MBTL1RAB9AMAPT
SCHEMBL539078 0.78 ELANE (0.50) ELANEATML3MBTL1MAPT
SCHEMBL131278 0.78 ELANE (0.51) ELANEATML3MBTL1MAPT

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