SCHEMBL28728366

SCHEMBL28728366

CN(C)c1ccc(C=NO)c(Cl)c1

nearest known ligand 0.47

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 4/20 0.47
ALDH1A1 P00352 4/20 0.47
MAPT P10636 3/20 0.47
GAA P10253 3/20 0.47
BACE1 P56817 4/20 0.45
SLC2A1 P11166 1/20 0.44
KMT2A Q03164 3/20 0.40
L3MBTL1 Q9Y468 1/20 0.40
TSHR P16473 2/20 0.37
HPGD P15428 1/20 0.37
TERT O14746 1/20 0.37
APP P05067 1/20 0.37
NPSR1 Q6W5P4 2/20 0.37
GRIN2D O15399 2/20 0.37
GRIN3B O60391 2/20 0.37
GRIN1 Q05586 2/20 0.37
GRIN2A Q12879 2/20 0.37
GRIN2B Q13224 2/20 0.37
GRIN2C Q14957 2/20 0.37
GRIN3A Q8TCU5 2/20 0.37

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
SCHEMBL5710804 0.79 ALDH1A1 (0.46) KDM4EALDH1A1MAPTGAABACE1
SCHEMBL5710802 0.79 ALDH1A1 (0.46) KDM4EALDH1A1MAPTGAABACE1
SCHEMBL29848301 0.76 TDP1 (0.55) KDM4EALDH1A1MAPTGAABACE1
SCHEMBL31251532 0.76 GABRA1 (0.50) KDM4EALDH1A1MAPTGAAKMT2A
SCHEMBL1002405 0.76 TDP1 (0.55) KDM4EALDH1A1MAPTGAABACE1
SCHEMBL453264 0.76 SLC2A1 (0.48) KDM4EALDH1A1MAPTGAABACE1
SCHEMBL4049047 0.75 MAPT (0.59) KDM4EALDH1A1MAPTGAAL3MBTL1
SCHEMBL2904656 0.75 MAPT (0.59) KDM4EALDH1A1MAPTGAAL3MBTL1
SCHEMBL29756954 0.75 MAPT (0.59) KDM4EALDH1A1MAPTGAAL3MBTL1
SCHEMBL2904660 0.75 MAPT (0.59) KDM4EALDH1A1MAPTGAAL3MBTL1

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-114262324-A Bixazole drug molecule capable of being used for hospital nursing sterilization and application thereof 河南科技大学第一附属医院 2022-04-01 CN claimed
CN-114262324-A Bixazole drug molecule capable of being used for hospital nursing sterilization and application thereof 河南科技大学第一附属医院 2022-04-01 CN disclosed