Phenetole

Phenetole

SCHEMBL28029045

CCOc1ccccc1.O.O=C(O)O.O=C(O)O

nearest known ligand 0.65

Full drug profile on Sugi Atlas →

Known targets — ChEMBL curated mechanism

GSK3AGSK3BIMPA1

The experimentally established mechanism targets of Phenetole. The predicted profile below is derived independently by chemical similarity — agreement is a validation signal, a miss is honest.

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LTA4H P09960 1/20 0.65
NQO1 P15559 1/20 0.56
L3MBTL1 Q9Y468 2/20 0.56
LMNA P02545 1/20 0.56
MAPK1 P28482 1/20 0.56
ALOX15 P16050 1/20 0.56
PARP10 Q53GL7 1/20 0.53
RELA Q04206 1/20 0.53
NPC1 O15118 4/20 0.53
RAB9A P51151 3/20 0.53
KMT2A Q03164 2/20 0.53
SMN1; SMN2 Q16637 2/20 0.53
MAPT P10636 2/20 0.53
HPGD P15428 1/20 0.53
MAOA P21397 1/20 0.53
MAOB P27338 1/20 0.53
GLA P06280 1/20 0.52
PLA2G4B P0C869 1/20 0.52
TDP1 Q9NUW8 1/20 0.51
MEN1 O00255 1/20 0.51

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
Phenetole SCHEMBL29242129 0.91 LTA4H (0.65) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL8364233 0.91 LTA4H (0.65) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL28000963 0.91 LTA4H (0.77) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL11569608 0.91 LTA4H (0.77) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL28364557 0.91 LTA4H (0.77) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL27945108 0.89 LTA4H (0.63) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL27893819 0.89 LTA4H (0.63) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL27782769 0.89 LTA4H (0.63) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL28236081 0.89 LTA4H (0.63) LTA4HNQO1L3MBTL1LMNAMAPK1
Phenetole SCHEMBL27502814 0.89 LTA4H (0.63) LTA4HNQO1L3MBTL1LMNAMAPK1

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-104870542-A Composite particles including a fluoropolymer, methods of making, and articles including the same 3M INNOVATIVE PROPERTIES CO 2015-08-26 CN disclosed