SCHEMBL28427005

SCHEMBL28427005

CCOP(=O)(F)OC(C)C

nearest known ligand 0.64

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
CTSA P10619 1/20 0.64
ACHE P22303 1/20 0.64
TSHR P16473 2/20 0.42
TP53 P04637 1/20 0.39
TDP1 Q9NUW8 1/20 0.39
PPARD Q03181 2/20 0.33
KDM4E B2RXH2 1/20 0.33
ALDH1A1 P00352 1/20 0.33
POLB P06746 1/20 0.33

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
SCHEMBL15137787 1.00 CTSA (0.64) CTSAACHETSHRTP53TDP1
SCHEMBL9938963 0.82 CTSA (0.58) CTSAACHEKDM4EALDH1A1POLB
SCHEMBL575446 0.79
Isoflurophate SCHEMBL63841 0.79 CTSA (1.00) CTSAACHETDP1KDM4EALDH1A1
SCHEMBL6115194 0.76 LPAR3 (0.50) CTSAACHE
SCHEMBL86164 0.75 TSHR (0.60) CTSAACHETSHRTP53TDP1
SCHEMBL3819715 0.75 TSHR (0.60) CTSAACHETSHRTP53TDP1
Isoflurophate SCHEMBL27896113 0.74 CTSA (0.88) CTSAACHETDP1KDM4EALDH1A1
SCHEMBL510277 0.72
SCHEMBL576372 0.72

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-111346213-A Tissue protective peptides and peptide analogs for the prevention and treatment of diseases and disorders associated with tissue damage 阿拉伊姆药品公司 2020-06-30 CN disclosed