SCHEMBL29907960

SCHEMBL29907960

COc1cc(CC(=O)NN)cc(OC)c1

nearest known ligand 0.54

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
MAPK8 P45983 1/20 0.54
L3MBTL1 Q9Y468 1/20 0.51
GLS O94925 2/20 0.49
HTT P42858 1/20 0.49
KMT2A Q03164 3/20 0.47
POLB P06746 1/20 0.47
SIGMAR1 Q99720 1/20 0.46
CA1 P00915 1/20 0.46
CA2 P00918 1/20 0.46
KDM4E B2RXH2 1/20 0.45
GAA P10253 1/20 0.45
PLA2G2A P14555 2/20 0.44
TACR1 P25103 1/20 0.43
MEN1 O00255 2/20 0.43
AOC2 O75106 1/20 0.42

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
SCHEMBL8838392 0.83 L3MBTL1 (0.53) MAPK8L3MBTL1GLSHTTKMT2A
SCHEMBL968090 0.83 POLB (0.59) MAPK8GLSHTTKMT2APOLB
SCHEMBL29664449 0.82 L3MBTL1 (0.49) MAPK8L3MBTL1GLSHTTKMT2A
SCHEMBL2494898 0.81 HTT (0.73) MAPK8HTTKMT2ACA1CA2
SCHEMBL2847513 0.79 MAPK8 (0.50) MAPK8L3MBTL1GLSKMT2APOLB
SCHEMBL348963 0.79 HSP90AB1 (0.62) MAPK8L3MBTL1GLSKMT2APOLB
SCHEMBL26414135 0.78 L3MBTL1 (0.46) MAPK8L3MBTL1KMT2APOLBSIGMAR1
SCHEMBL17730733 0.77 CACNA1H (0.44) HTTKMT2AKDM4EGAAMEN1
SCHEMBL347352 0.76 PTGS1 (0.59) L3MBTL1KMT2APOLBKDM4EGAA
SCHEMBL1162659 0.76 ALDH1A1 (0.48) MAPK8L3MBTL1GLSKMT2APOLB

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-114989131-B N' - (2- (benzo [1,3] dioxolan-5-yl) acyl) aryl hydrazide compound as well as synthesis and application thereof 云南大学 2023-10-24 CN disclosed
CN-114989131-A N' - (2- (benzo [1,3] dioxolane-5-yl) acyl) aroyl hydrazide compound and synthesis and application thereof 云南大学 2022-09-02 CN disclosed