SCHEMBL29064869

SCHEMBL29064869

CC(C)(C)[Si](C)(C)OCCCNc1cc(-c2cccnc2)ccc1NC(=O)O

nearest known ligand 0.43

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MKNK1 Q9BUB5 2/20 0.43
MKNK2 Q9HBH9 2/20 0.43
CNR2 P34972 2/20 0.41
ABCB1 P08183 9/20 0.41
DYRK1A Q13627 2/20 0.39
WNT1 P04628 1/20 0.39
CLK2 P49760 1/20 0.39
CLK3 P49761 1/20 0.39
ABCC1 P33527 2/20 0.39
EGFR P00533 1/20 0.39
FGFR1 P11362 1/20 0.39
KDR P35968 1/20 0.39
HTR6 P50406 1/20 0.39
SLC2A1 P11166 1/20 0.39
CYP19A1 P11511 1/20 0.38
CYP11B1 P15538 1/20 0.38
CYP11B2 P19099 1/20 0.38
HDAC3 O15379 1/20 0.38
HDAC1 Q13547 1/20 0.38
HDAC2 Q92769 1/20 0.38

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
SCHEMBL24335577 0.90 NAMPT (0.41) MKNK1MKNK2CNR2ABCB1DYRK1A
SCHEMBL24359424 0.83 MKNK1 (0.39) MKNK1MKNK2CNR2DYRK1AWNT1
SCHEMBL29064834 0.82 MKNK2 (0.47) MKNK1MKNK2CNR2ABCB1DYRK1A
SCHEMBL29580299 0.80 ABCB1 (0.48) ABCB1ABCC1CYP11B1CYP11B2
SCHEMBL29530372 0.76 MKNK2 (0.44) MKNK1MKNK2CNR2ABCB1DYRK1A
SCHEMBL24335569 0.76 MKNK2 (0.44) MKNK1MKNK2CNR2ABCB1DYRK1A
SCHEMBL31096195 0.70 KDM4E (0.49) MKNK1MKNK2CYP19A1CYP11B1CYP11B2
SCHEMBL28842381 0.69 HDAC1 (0.49) MKNK1MKNK2ABCB1HTR6SLC2A1
SCHEMBL2465121 0.69 ABCB1 (0.57) MKNK1MKNK2ABCB1HDAC3HDAC1
SCHEMBL15823575 0.67 SUCNR1 (0.41) HDAC3HDAC1HDAC2

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-116528867-A Compounds for the treatment of Alzheimer's disease 艾伯塔大学理事会 2023-08-01 CN disclosed