SCHEMBL28026889

SCHEMBL28026889

N#CC1=C(N(N)C(N)=O)SC(N(N)C(N)=O)=C(C#N)C1c1ccc(F)cc1

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CUL4A Q13619 4/20 0.54
ALDH1A1 P00352 11/20 0.38
MEN1 O00255 9/20 0.38
KMT2A Q03164 9/20 0.38
KDM4E B2RXH2 8/20 0.38
HSD17B10 Q99714 5/20 0.38
ALOX15 P16050 4/20 0.38
BRCA1 P38398 3/20 0.38
MAPT P10636 9/20 0.37
ALOX12 P18054 4/20 0.37
USP2 O75604 2/20 0.37
PRNP P04156 1/20 0.37
IDO1 P14902 1/20 0.36
LMNA P02545 5/20 0.36
HPGD P15428 4/20 0.36
GFER P55789 1/20 0.35
L3MBTL1 Q9Y468 2/20 0.34
GAA P10253 2/20 0.34
HTT P42858 1/20 0.34
NPSR1 Q6W5P4 1/20 0.34

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
SCHEMBL28026887 0.86 KMT2A (0.40) CUL4AALDH1A1MEN1KMT2AKDM4E
SCHEMBL28026886 0.86 CUL4A (0.51) CUL4AALDH1A1MEN1KMT2AKDM4E
SCHEMBL28026888 0.85 KMT2A (0.43) CUL4AALDH1A1MEN1KMT2AKDM4E
SCHEMBL28027514 0.83 CUL4A (0.54) CUL4AALDH1A1MEN1KMT2AKDM4E
SCHEMBL28026892 0.83 CUL4A (0.48) CUL4AALDH1A1MEN1KMT2AKDM4E
SCHEMBL28027509 0.80 CUL4A (0.55) CUL4AALDH1A1MEN1KMT2AKDM4E
SCHEMBL28026890 0.78 EEF2K (0.56) CUL4AALDH1A1MEN1KMT2AKDM4E
SCHEMBL28027503 0.73 CUL4A (0.59) CUL4A
SCHEMBL15571642 0.71 CUL4A (1.00) CUL4AALDH1A1MEN1KMT2AKDM4E
SCHEMBL28027511 0.69 ALDH1A1 (0.58) CUL4AALDH1A1MEN1KMT2AKDM4E

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-104968323-A Inhibitors of CRL4 ubiquitin ligase and uses thereof UNIV CORNELL 2015-10-07 CN claimed
CN-104968323-A Inhibitors of CRL4 ubiquitin ligase and uses thereof UNIV CORNELL 2015-10-07 CN disclosed