SCHEMBL8382140

SCHEMBL8382140

CC(O)N(C(=O)Nc1c(I)c(C(=O)NCCO)c(I)c(C(=O)NC(CO)CO)c1I)c1c(I)c(C(=O)NCCO)c(I)c(C(=O)NC(CO)CO)c1I

nearest known ligand 0.56

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.56
CYP2C19 P33261 1/20 0.37
HIF1A Q16665 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
SCHEMBL8380584 0.87 LMNA (0.52) LMNACYP2C19HIF1A
SCHEMBL8377045 0.86 LMNA (0.47) LMNACYP2C19HIF1A
SCHEMBL8381823 0.83 CYP2C19 (0.52) LMNACYP2C19HIF1A
SCHEMBL8382143 0.83 LMNA (0.49) LMNACYP2C19HIF1A
SCHEMBL14310826 0.82 LMNA (0.83) LMNACYP2C19HIF1A
SCHEMBL8378595 0.81 LMNA (0.60) LMNACYP2C19HIF1A
SCHEMBL8378482 0.81 LMNA (0.57) LMNACYP2C19HIF1A
SCHEMBL619948 0.81 LMNA (0.60) LMNACYP2C19HIF1A
SCHEMBL8375497 0.78 LMNA (0.56) LMNACYP2C19HIF1A
SCHEMBL966193 0.75 LMNA (0.67) LMNACYP2C19HIF1A

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-0782565-B1 IODINATED X-RAY-CONTRAST MEDIA NYCOMED IMAGING AS (NO) 1999-04-07 EP disclosed