SCHEMBL27768012

SCHEMBL27768012

CCOC(=O)CN(C)c1ccc(C(C)=O)cc1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CA12 O43570 2/20 0.45
CA1 P00915 2/20 0.45
CA2 P00918 2/20 0.45
CA9 Q16790 2/20 0.45
MAPT P10636 5/20 0.42
RAB9A P51151 5/20 0.42
NPC1 O15118 4/20 0.42
KDM4E B2RXH2 1/20 0.42
MAPK1 P28482 1/20 0.42
KMT2A Q03164 2/20 0.42
GAA P10253 2/20 0.42
MEN1 O00255 1/20 0.42
POLB P06746 1/20 0.42
MCL1 Q07820 1/20 0.42
NOX1 Q9Y5S8 1/20 0.42
HPGD P15428 1/20 0.39
L3MBTL1 Q9Y468 3/20 0.39
ALDH1A1 P00352 1/20 0.39
ESR1 P03372 1/20 0.39
CA7 P43166 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
SCHEMBL28703573 0.85 RAB9A (0.45) CA12CA1CA2CA9MAPT
SCHEMBL7448315 0.83 KMT2A (0.49) CA12CA1CA2CA9MAPT
SCHEMBL22537802 0.82 HCRTR2 (0.44) CA12CA1CA2CA9MAPT
SCHEMBL15986419 0.82 MAPT (0.47) CA12CA1CA2CA9MAPT
SCHEMBL557889 0.81 SMN1; SMN2 (0.55) CA12CA1CA2CA9MAPT
SCHEMBL29194883 0.81 PPARG (0.51) MAPTRAB9ANPC1KMT2AGAA
Hydrochloric Acid SCHEMBL7150239 0.80 SMN1; SMN2 (0.54) CA12CA1CA2CA9MAPT
SCHEMBL20004346 0.79 LMNA (0.43) CA12CA1CA2CA9MAPT
SCHEMBL13624059 0.79 HCRTR2 (0.46) CA12CA1CA2CA9MAPT
SCHEMBL6546411 0.79 ALDH1A1 (0.46) CA12CA1CA2CA9MAPT

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-102643248-A Activating agent for peroxisome proliferator activated receptor NIPPON CHEMIPHAR CO 2012-08-22 CN disclosed
CN-101466687-B Activator of peroxisome proliferator activated receptor delta NIPPON CHEMIPHAR CO 2012-04-11 CN disclosed
CN-101466687-A Activator of peroxisome proliferator activated receptor delta NIPPON CHEMIPHAR CO (JP) 2009-06-24 CN disclosed