SCHEMBL7797724

SCHEMBL7797724

C[C@H](O)C(=O)Nc1c(I)c(C(=O)O)c(I)c(C(=O)O)c1I

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.60
SMN1; SMN2 Q16637 1/20 0.43
TSHR P16473 1/20 0.35
MAPK1 P28482 1/20 0.35
TP53 P04637 1/20 0.31
CSNK2A2 P19784 1/20 0.30
CSNK2B P67870 1/20 0.30
CSNK2A1 P68400 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
SCHEMBL7797725 1.00 LMNA (0.60) LMNASMN1; SMN2TSHRMAPK1TP53
Hydrochloric Acid SCHEMBL377316 0.98 LMNA (0.59) LMNASMN1; SMN2TSHRMAPK1TP53
SCHEMBL11712248 0.85 LMNA (0.58) LMNASMN1; SMN2TSHRMAPK1
SCHEMBL31409203 0.84 LMNA (0.90) LMNASMN1; SMN2TSHRMAPK1
SCHEMBL377315 0.84 LMNA (0.59) LMNASMN1; SMN2
SCHEMBL7046446 0.84 LMNA (0.63) LMNASMN1; SMN2
SCHEMBL28309840 0.84 LMNA (0.63) LMNASMN1; SMN2
SCHEMBL17343608 0.82 LMNA (0.66) LMNASMN1; SMN2
SCHEMBL7581409 0.78 LMNA (0.42) LMNASMN1; SMN2TSHRMAPK1
SCHEMBL7581413 0.78 LMNA (0.42) LMNASMN1; SMN2TSHRMAPK1

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
US-4364921-A RADIOPACITY SCHERING, AKTIENGESELLSCHAFT (DE) 1982-12-21 US claimed
EP-0015867-B1 DIAMIDES OF TRIIODO-ISOPHTHALIC ACIDS, THEIR PREPARATION AND X-RAY CONTRAST AGENTS CONTAINING THEM SCHERING AKTIENGESELLSCHAFT (DE) 1982-05-19 EP claimed
EP-0851854-B1 PROCESS FOR THE PURIFICATION OF AN INTERMEDIATE IN THE PREPARATION OF IOPAMIDOL BRACCO IMAGING SPA (IT) 2001-12-12 EP disclosed
US-4364921-A RADIOPACITY SCHERING, AKTIENGESELLSCHAFT (DE) 1982-12-21 US disclosed