SCHEMBL28820121

SCHEMBL28820121

CC(=O)CC(=O)c1cc(Cl)ccc1C(N)=O

nearest known ligand 0.54

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 5/20 0.54
ALDH1A1 P00352 4/20 0.54
GLA P06280 1/20 0.54
GAA P10253 1/20 0.54
ERCC5 P28715 2/20 0.45
FEN1 P39748 2/20 0.45
MAPT P10636 4/20 0.45
NOS2 P35228 1/20 0.44
LMNA P02545 4/20 0.43
HTT P42858 4/20 0.43
MEN1 O00255 4/20 0.43
KMT2A Q03164 4/20 0.43
HPGD P15428 3/20 0.43
KCNH2 Q12809 2/20 0.43
PLA2G1B P04054 1/20 0.43
XBP1 P17861 1/20 0.43
ALOX12 P18054 1/20 0.43
ATG4B Q9Y4P1 1/20 0.43
ABL1 P00519 1/20 0.42
MAPK1 P28482 2/20 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
SCHEMBL10964252 0.81 NOS2 (0.60) KDM4EALDH1A1GLAGAAERCC5
SCHEMBL8492279 0.81 ERCC5 (0.67) KDM4EALDH1A1ERCC5FEN1MAPT
SCHEMBL27929753 0.80 KDM4E (0.58) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL3790275 0.80 ALDH1A1 (0.60) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL14706719 0.79 LMNA (0.65) KDM4EERCC5FEN1MAPTLMNA
SCHEMBL28019534 0.79 ALDH1A1 (0.49) KDM4EALDH1A1GLAGAAMAPT
Nitrogen SCHEMBL27881823 0.77 KDM4E (0.54) KDM4EALDH1A1GLAGAAMAPT
SCHEMBL11034355 0.76 LMNA (0.44) KDM4EALDH1A1GLAGAAERCC5
SCHEMBL27658314 0.76 HTT (0.51) KDM4EALDH1A1GLAGAANOS2
SCHEMBL28680085 0.76 ALDH1A1 (0.62) KDM4EALDH1A1GLAGAAMAPT

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-105143353-A Disazo pigment composition and method for producing same TOYO INK SC HOLDINGS CO LTD 2015-12-09 CN disclosed
CN-104629401-A Bisazo disperse dye and preparation method and application thereof NANJING UNIVERSITY OF TECHNOLOGY 2015-05-20 CN disclosed