E388

E388

SCHEMBL11207276

CNc1c(I)c(C(=O)Cl)c(I)c(C(=O)Cl)c1I.Nc1c(I)c(C(=O)Cl)c(I)c(C(=O)Cl)c1I.O=C(O)CCSCCC(=O)O

nearest known ligand 0.37

Full drug profile on Sugi Atlas →

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
LMNA P02545 1/20 0.37
KMT2A Q03164 1/20 0.37
HSD17B10 Q99714 1/20 0.37
TDP1 Q9NUW8 1/20 0.37

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
E388 SCHEMBL11200228 0.89 LMNA (0.47) LMNAKMT2AHSD17B10TDP1
SCHEMBL11170124 0.83 BHMT (0.42) LMNAKMT2AHSD17B10TDP1
SCHEMBL11202584 0.81 TSHR (0.45) LMNAKMT2AHSD17B10TDP1
Malonic Acid SCHEMBL11497552 0.78 LDHA (0.33) LMNA
SCHEMBL3062802 0.76 LMNA (0.34) LMNA
SCHEMBL8905904 0.75 LIMK1 (0.36) LMNA
Adipic Acid SCHEMBL11497568 0.75 LMNA (0.41) LMNAKMT2AHSD17B10TDP1
Malonic Acid SCHEMBL11132579 0.75 LDHA (0.36)
SCHEMBL11202657 0.74 BHMT (0.38) HSD17B10
SCHEMBL11194793 0.72 GMNN (0.42) HSD17B10

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
US-4367216-A X-RAYS, CONTRAST, OPACITY SCHERING AKTIENGESELLSCHAFT (DE) 1983-01-04 US disclosed