SCHEMBL28756194

SCHEMBL28756194

COc1c(CC(N)=O)cc(C(C)(C)C)cc1OC(N)=O

nearest known ligand 0.39

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
GSK3A P49840 16/20 0.39
SRC P12931 14/20 0.39
MAPK14 Q16539 13/20 0.39
SYK P43405 7/20 0.39

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
SCHEMBL28756114 0.83 GSK3A (0.39) GSK3ASRCMAPK14SYK
SCHEMBL28756081 0.82 SRC (0.40) GSK3ASRCMAPK14SYK
SCHEMBL16829546 0.81 GSK3A (0.40) GSK3ASRCMAPK14SYK
SCHEMBL28756124 0.78 MEN1 (0.38) GSK3ASRCMAPK14SYK
SCHEMBL19434654 0.77 ALDH1A1 (0.36) MAPK14
SCHEMBL28942237 0.76 CA1 (0.38) GSK3AMAPK14
SCHEMBL16829471 0.76 GSK3A (0.49) GSK3ASRCMAPK14SYK
SCHEMBL16829308 0.76 ALDH1A1 (0.44) GSK3ASRCMAPK14SYK
SCHEMBL28650716 0.75 MAPT (0.33)
SCHEMBL28756320 0.75 MAPK14 (0.37) GSK3ASRCMAPK14SYK

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-113717162-A Urea derivatives as kinase inhibitors 奥苏拉收购有限公司 2021-11-30 CN disclosed