SCHEMBL5822170

SCHEMBL5822170

COC1=C(O)C(=O)c2c(O)c(OC)c(OC)c(O)c2C1=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
PIM1 P11309 1/20 0.39
PDE4A P27815 4/20 0.38
PDE4B Q07343 4/20 0.38
PDE4C Q08493 4/20 0.38
PDE4D Q08499 4/20 0.38
EPHX2 P34913 2/20 0.38
GRIN2D O15399 1/20 0.35
GRIN3B O60391 1/20 0.35
GRIN1 Q05586 1/20 0.35
GRIN2A Q12879 1/20 0.35
GRIN2B Q13224 1/20 0.35
GRIN2C Q14957 1/20 0.35
GRIN3A Q8TCU5 1/20 0.35
MAPT P10636 8/20 0.34
ALDH1A1 P00352 5/20 0.34
MEN1 O00255 4/20 0.34
KMT2A Q03164 4/20 0.34
KDM4E B2RXH2 4/20 0.34
HPGD P15428 2/20 0.34
RECQL P46063 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
SCHEMBL5821580 0.92 PIM1 (0.47) PIM1PDE4APDE4BPDE4CPDE4D
SCHEMBL5818903 0.92 PIM1 (0.47) PIM1PDE4APDE4BPDE4CPDE4D
SCHEMBL5818650 0.87 MAPT (0.38) PIM1MAPTALDH1A1MEN1KMT2A
SCHEMBL5816978 0.77 KDM4E (0.53) PIM1EPHX2MAPTALDH1A1MEN1
SCHEMBL9175352 0.77 MAPT (0.42) PIM1PDE4BMAPTALDH1A1MEN1
SCHEMBL5821883 0.75 EGFR (0.51) PIM1MAPTALDH1A1MEN1KMT2A
SCHEMBL5807302 0.74 PDE4A (0.48) PIM1PDE4APDE4BPDE4CPDE4D
SCHEMBL5816765 0.74 PDE4A (0.48) PIM1PDE4APDE4BPDE4CPDE4D
SCHEMBL21727072 0.74 MAPT (0.44) PIM1PDE4BMAPTALDH1A1MEN1
SCHEMBL5817284 0.69 KCNA3 (0.36) PIM1PDE4APDE4BPDE4CPDE4D

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
WO-2006107827-A1 SKIN BONDING PROCESS CREIGHTON UNIVERSITY (US) 2006-10-12 WO disclosed