SCHEMBL28835490

SCHEMBL28835490

CC(=O)OCCC(OC(C)=O)c1c(I)c(C(N)=O)c(I)c(C(N)=O)c1I

nearest known ligand 0.40

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
ALOX15 P16050 1/20 0.33
ALDH1A1 P00352 1/20 0.30

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
SCHEMBL8357777 0.81 ALDH1A1 (0.33) ALDH1A1
SCHEMBL28835487 0.73 TDP1 (0.33) ALDH1A1
SCHEMBL9191045 0.73 ALOX15 (0.31) ALOX15
SCHEMBL9191053 0.71
SCHEMBL8357781 0.69 ALDH1A1 (0.41) ALDH1A1
SCHEMBL9191039 0.68 TDP1 (0.35) ALOX15
SCHEMBL7986009 0.68 TDP1 (0.36)
SCHEMBL5357733 0.67 LMNA (0.31) ALOX15
SCHEMBL9389062 0.66 PABPC1 (0.50) ALDH1A1
SCHEMBL8586708 0.66 LMNA (0.43)

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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-115010617-B Preparation method of iopamidol 安徽普利药业有限公司 2024-06-11 CN disclosed
CN-115010617-A Preparation method of iopamidol 安徽普利药业有限公司 2022-09-06 CN disclosed