SCHEMBL8948721

SCHEMBL8948721

CN(C(=O)CCCC(=O)O)c1c(I)c(C(=O)O)c(I)c(C(=O)O)c1I

nearest known ligand 0.46

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
SLC22A6 Q4U2R8 1/20 0.35
FOLH1 Q04609 1/20 0.32
KDM4A O75164 11/20 0.32
KDM4C Q9H3R0 11/20 0.32
PHF8 Q9UPP1 2/20 0.32
KDM2A Q9Y2K7 2/20 0.32
KDM5A P29375 1/20 0.32
KDM7A Q6ZMT4 1/20 0.32
TSHR P16473 1/20 0.32
LMNA P02545 1/20 0.31
BBOX1 O75936 1/20 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
SCHEMBL11632881 0.97 SLC22A6 (0.35) SLC22A6FOLH1KDM4AKDM4CPHF8
SCHEMBL11635038 0.91 LMNA (0.32) SLC22A6FOLH1LMNABBOX1
SCHEMBL11635913 0.90 PHF8 (0.31) SLC22A6PHF8KDM2A
SCHEMBL11631906 0.87 KDM4A (0.34) SLC22A6KDM4AKDM4CPHF8KDM2A
SCHEMBL8948812 0.85 TSHR (0.43) KDM5ATSHRLMNA
SCHEMBL11634546 0.83 LMNA (0.51) KDM4AKDM4CPHF8KDM2AKDM5A
SCHEMBL11630987 0.80 TSHR (0.43) SLC22A6KDM4CPHF8KDM5ATSHR
SCHEMBL11634393 0.80 LMNA (0.31) LMNA
SCHEMBL11629552 0.80 KDM5A (0.30) KDM4CKDM5A
SCHEMBL11631966 0.78 MAPK1 (0.43) TSHRLMNA

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-5463080-A 2,4,6-triiodo-1,3-benzenedicarboxylic acid compounds used as radiolabelling reagents BRACCO INTERNATIONAL B.V. (NL) 1995-10-31 US claimed
US-5569446-A Radiohalogenation of proteins using trihalophenyl derivatives BRACCO INTERNATIONAL B.V. 1996-10-29 US disclosed
US-5463080-A 2,4,6-triiodo-1,3-benzenedicarboxylic acid compounds used as radiolabelling reagents BRACCO INTERNATIONAL B.V. (NL) 1995-10-31 US disclosed