SCHEMBL9112274

SCHEMBL9112274

CC(=O)OCC(=O)Nc1c(I)c(C(N)=O)c(I)c(C(=O)N(CC(COC(C)=O)OC(C)=O)CC(COC(C)=O)OC(C)=O)c1I

nearest known ligand 0.39

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.39
SMN1; SMN2 Q16637 2/20 0.31
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
SCHEMBL7589122 0.88 LMNA (0.36) LMNASMN1; SMN2ALDH1A1
SCHEMBL8743496 0.83 AR (0.31)
SCHEMBL28880451 0.82 LMNA (0.43) LMNASMN1; SMN2ALDH1A1
SCHEMBL31526066 0.81
SCHEMBL8556245 0.81
SCHEMBL7527411 0.81
SCHEMBL8857312 0.80 LMNA (0.42) LMNA
SCHEMBL8743500 0.80 ALDH1A1 (0.39) LMNASMN1; SMN2ALDH1A1
SCHEMBL31526056 0.79 AR (0.32)
SCHEMBL5318579 0.79 AR (0.32)

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-0628024-A4 SYNTHESIS OF IOVERSOL USING A MINIMAL EXCESS OF ACETOXYACETYLCHLORIDE. MALLINCKRODT MEDICAL INC (US) 1995-03-22 EP claimed
EP-0628024-A1 SYNTHESIS OF IOVERSOL USING A MINIMAL EXCESS OF ACETOXYACETYLCHLORIDE MALLINCKRODT MEDICAL, INC. (US) 1994-12-14 EP claimed
EP-0628024-A4 SYNTHESIS OF IOVERSOL USING A MINIMAL EXCESS OF ACETOXYACETYLCHLORIDE. MALLINCKRODT MEDICAL INC (US) 1995-03-22 EP disclosed
EP-0628024-A1 SYNTHESIS OF IOVERSOL USING A MINIMAL EXCESS OF ACETOXYACETYLCHLORIDE MALLINCKRODT MEDICAL, INC. (US) 1994-12-14 EP disclosed