SCHEMBL8675281

SCHEMBL8675281

NC(=O)c1cccc(-c2c(C(N)=O)c(C(N)=O)c3c(c2-c2cccc(C(N)=O)c2C(N)=O)-c2ccccc2-3)c1C(N)=O

nearest known ligand 0.56

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KEAP1 Q14145 1/20 0.56
NFE2L2 Q16236 1/20 0.56
BCAT2 O15382 1/20 0.48
ALDH1A1 P00352 4/20 0.44
KDM4E B2RXH2 2/20 0.44
MAPT P10636 2/20 0.44
HPGD P15428 1/20 0.44
TSHR P16473 1/20 0.44
HSD17B10 Q99714 1/20 0.44
PDK2 Q15119 1/20 0.43
CSNK1A1 P48729 1/20 0.42
TYRO3 Q06418 1/20 0.42
DYRK1B Q9Y463 1/20 0.42
METAP2 P50579 1/20 0.41
MYC P01106 1/20 0.41
GAA P10253 1/20 0.41
PARP1 P09874 3/20 0.40
PDPK1 O15530 1/20 0.40
GRK6 P43250 1/20 0.39
HNF4A P41235 1/20 0.38

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
SCHEMBL402013 0.86 BCAT2 (0.56) KEAP1NFE2L2BCAT2ALDH1A1KDM4E
SCHEMBL7524098 0.85 BCAT2 (0.46) KEAP1NFE2L2BCAT2ALDH1A1KDM4E
SCHEMBL5608858 0.84 BCAT2 (0.61) KEAP1NFE2L2BCAT2ALDH1A1KDM4E
SCHEMBL1286522 0.82 KEAP1 (0.41) KEAP1NFE2L2BCAT2ALDH1A1KDM4E
SCHEMBL901580 0.79 BCAT2 (0.71) KEAP1NFE2L2BCAT2ALDH1A1KDM4E
SCHEMBL3453140 0.79 KDM4E (0.61) KEAP1NFE2L2BCAT2ALDH1A1KDM4E
SCHEMBL5742619 0.78 MYC (0.53) KEAP1NFE2L2BCAT2ALDH1A1KDM4E
SCHEMBL28309606 0.77 KEAP1 (0.44) KEAP1NFE2L2BCAT2ALDH1A1KDM4E
SCHEMBL466296 0.77 KDM4E (0.54) KEAP1NFE2L2BCAT2ALDH1A1KDM4E
SCHEMBL8910680 0.76 KDM4E (0.51) KEAP1NFE2L2BCAT2ALDH1A1KDM4E

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
US-5719238-A ADDING A MINOR AMOUNT OF ARAMIDE POWDER SHELL OIL COMPANY (US) 1998-02-17 US claimed