SCHEMBL9009268

SCHEMBL9009268

NCC(=O)Nc1c(I)c(C(=O)N(CCO)CCO)c(I)c(C(=O)N(CCO)CCO)c1I

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
LMNA P02545 4/20 0.36
TSHR P16473 1/20 0.32
MAPK1 P28482 1/20 0.32
CA1 P00915 2/20 0.31
CA2 P00918 2/20 0.31

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
SCHEMBL5555274 0.84 LMNA (0.34) LMNATSHRMAPK1CA1CA2
SCHEMBL621840 0.82 LMNA (0.49) LMNA
Iosimide SCHEMBL898150 0.80 CA2 (0.33) CA1CA2
Iosimide SCHEMBL8845588 0.80 CA2 (0.33) CA1CA2
SCHEMBL7590959 0.79 LMNA (0.34) LMNA
SCHEMBL7607980 0.78 LMNA (0.47) LMNA
SCHEMBL9194186 0.78 LMNA (0.47) LMNATSHRMAPK1
SCHEMBL9191001 0.77 LMNA (0.44) LMNA
SCHEMBL10454950 0.76 LMNA (0.53) LMNA
SCHEMBL11387512 0.75 TSHR (0.47) LMNATSHRMAPK1CA1CA2

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
EP-0571593-B1 NEW NON IONIC IODIZED AGENTS FOR X-RAY CONTRASTING, METHOD FOR PREPARING THEM AND GALENICAL COMPOSITIONS CONTAINING THEM INVEST JUSTESA IMAGEN S A CENT (ES) 1996-10-30 EP disclosed