SCHEMBL28835657

SCHEMBL28835657

CCOC(=O)c1n[nH]c2c1C(=O)CC2

nearest known ligand 0.47

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
POLB P06746 1/20 0.47
KDM4E B2RXH2 3/20 0.44
L3MBTL1 Q9Y468 2/20 0.43
BRD4 O60885 1/20 0.43
PDE4D Q08499 1/20 0.41
KMT2A Q03164 3/20 0.39
MEN1 O00255 2/20 0.39
MAPT P10636 2/20 0.39
ALOX15 P16050 1/20 0.39
HSD17B10 Q99714 1/20 0.39
CCNA2 P20248 2/20 0.37
CDK2 P24941 2/20 0.37
CCNA1 P78396 2/20 0.37
NPSR1 Q6W5P4 1/20 0.36
LMNA P02545 2/20 0.36
CYP1A2 P05177 1/20 0.36
CYP2C9 P11712 1/20 0.36
RAB9A P51151 1/20 0.35

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
SCHEMBL6485837 0.91 BRD4 (0.50) POLBKDM4EL3MBTL1BRD4PDE4D
SCHEMBL28835658 0.81 KDM4E (0.45) POLBKDM4EL3MBTL1BRD4PDE4D
SCHEMBL13935666 0.78 POLB (0.46) POLBKDM4EL3MBTL1BRD4PDE4D
SCHEMBL21995909 0.75 POLB (0.46) POLBKDM4EL3MBTL1BRD4PDE4D
SCHEMBL5225936 0.74 HTT (0.44) POLBKDM4EL3MBTL1PDE4DKMT2A
SCHEMBL5079536 0.74 HCAR2 (0.58) POLBKDM4EBRD4PDE4DKMT2A
SCHEMBL5951775 0.74 KMT2A (0.58) POLBKDM4EBRD4PDE4DKMT2A
SCHEMBL7420866 0.74 HCAR2 (0.50) POLBKDM4EBRD4PDE4DKMT2A
SCHEMBL1149314 0.73 TSHR (0.59) POLBKDM4EPDE4DKMT2AMEN1
SCHEMBL7421094 0.72 TSHR (0.51) POLBKDM4EBRD4PDE4DKMT2A

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-114874143-A Regulator containing pyrazole derivatives, preparation method and application thereof 上海翰森生物医药科技有限公司 2022-08-09 CN disclosed