SCHEMBL9502884

SCHEMBL9502884

CC(C)c1ccc2c(=O)cc(OC(=O)O)[nH]c2c1

nearest known ligand 0.50

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EIF4A3 P38919 4/20 0.50
KIF11 P52732 1/20 0.44
AURKA O14965 1/20 0.40
DAPK3 O43293 1/20 0.40
JAK2 O60674 1/20 0.40
MAP4K4 O95819 1/20 0.40
PAK4 O96013 1/20 0.40
ABL1 P00519 1/20 0.40
LCK P06239 1/20 0.40
FYN P06241 1/20 0.40
CSF1R P07333 1/20 0.40
RET P07949 1/20 0.40
IGF1R P08069 1/20 0.40
FLT1 P17948 1/20 0.40
LTK P29376 1/20 0.40
KDR P35968 1/20 0.40
FLT3 P36888 1/20 0.40
MAPK8 P45983 1/20 0.40
MAPK9 P45984 1/20 0.40
CLK2 P49760 1/20 0.40

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
SCHEMBL9452239 0.78 EIF4A3 (0.66) EIF4A3KIF11KDM4EGAAMEN1
SCHEMBL10809192 0.76 KDM4E (0.58) KDM4EGAAMEN1KMT2AMAPT
SCHEMBL9501058 0.76 GPR84 (0.41) GSK3BKDM4EMEN1KMT2ALMNA
SCHEMBL9499282 0.75 CCNB2 (0.38) KIF11GSK3AGSK3BCDK5ALK
SCHEMBL9502841 0.75 CTSV (0.46) LMNAHPGD
SCHEMBL13024464 0.74 LMNA (0.60) EIF4A3KIF11AURKADAPK3JAK2
SCHEMBL9388968 0.74 KIF11 (0.49) EIF4A3KIF11AURKADAPK3JAK2
SCHEMBL9452225 0.72 ALDH1A1 (0.48) EIF4A3KIF11KDM4EGAAMEN1
SCHEMBL9500319 0.71 CDK1 (0.37) KMT2ACDK1CDK2
SCHEMBL9500206 0.69 ALDH1A1 (0.49) GSK3BKDM4EGAAMEN1KMT2A

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
EP-0303387-B1 KYNURENIC ACID DERIVATIVES USEFUL IN THE TREATMENT OF NEURODEGENERATIVE DISORDERS MERCK SHARP & DOHME LTD. (GB) 1993-04-21 EP claimed