SCHEMBL8760935

SCHEMBL8760935

CCOC(=O)C(OC(=O)c1c(I)c(NC(C)=O)c(I)c(C(=O)OC(C(=O)OCC)C2CCCC2)c1I)C1CCCC1

nearest known ligand 0.37

Predicted protein targets (top 13)

geneUniProtsupporting neighboursconfidence
TSHR P16473 5/20 0.37
LMNA P02545 2/20 0.36
SMN1; SMN2 Q16637 1/20 0.34
KDM4E B2RXH2 1/20 0.34
ALDH1A1 P00352 5/20 0.34
NPSR1 Q6W5P4 1/20 0.34
GAA P10253 2/20 0.34
MEN1 O00255 1/20 0.34
KMT2A Q03164 1/20 0.34
L3MBTL1 Q9Y468 2/20 0.33
HPGD P15428 1/20 0.33
RAB9A P51151 1/20 0.32
MAPT P10636 1/20 0.32

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
SCHEMBL8761149 0.99 TSHR (0.39) TSHRLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL8760937 0.98 LMNA (0.39) TSHRLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL8752131 0.84 LMNA (0.42) TSHRLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL333577 0.81 LMNA (0.45) TSHRLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL8726308 0.78 LMNA (0.41) TSHRLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL371082 0.77 LMNA (0.46) TSHRLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL8814469 0.77 LMNA (0.50) TSHRLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL8752124 0.76 LMNA (0.39) TSHRLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL332721 0.75 LMNA (0.44) TSHRLMNASMN1; SMN2KDM4EALDH1A1
SCHEMBL9076702 0.75 LMNA (0.44) TSHRLMNASMN1; SMN2KDM4EALDH1A1

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-0767779-A1 ALPHA-(CYCLOALKYL, ARYL AND ARALKYL)SUBSTITUTED POLYIODINATED AROYLOXY COMPOUNDS NanoSystems L.L.C. (US) 1997-04-16 EP claimed
WO-1996000211-A1 ALPHA-(CYCLOALKYL, ARYL AND ARALKYL)SUBSTITUTED POLYIODINATED AROYLOXY COMPOUNDS NANOSYSTEMS L.L.C. (US) 1996-01-04 WO claimed
EP-0767779-A1 ALPHA-(CYCLOALKYL, ARYL AND ARALKYL)SUBSTITUTED POLYIODINATED AROYLOXY COMPOUNDS NanoSystems L.L.C. (US) 1997-04-16 EP disclosed
WO-1996000211-A1 ALPHA-(CYCLOALKYL, ARYL AND ARALKYL)SUBSTITUTED POLYIODINATED AROYLOXY COMPOUNDS NANOSYSTEMS L.L.C. (US) 1996-01-04 WO disclosed