SCHEMBL8586708

SCHEMBL8586708

CC(=O)OC(C)C(=O)Nc1c(I)c(C(N)=O)c(I)c(C(N)=O)c1I

nearest known ligand 0.43

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
LMNA P02545 3/20 0.43
HDAC3 O15379 1/20 0.32
HDAC4 P56524 1/20 0.32
HDAC1 Q13547 1/20 0.32
HDAC7 Q8WUI4 1/20 0.32
HDAC2 Q92769 1/20 0.32
HDAC10 Q969S8 1/20 0.32
HDAC11 Q96DB2 1/20 0.32
HDAC8 Q9BY41 1/20 0.32
HDAC6 Q9UBN7 1/20 0.32
HDAC9 Q9UKV0 1/20 0.32
HDAC5 Q9UQL6 1/20 0.32
KMT2A Q03164 1/20 0.31
SMN1; SMN2 Q16637 1/20 0.31
POLB P06746 1/20 0.31
TSHR P16473 1/20 0.31
KLK7 P49862 2/20 0.30
HKDC1 Q2TB90 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
SCHEMBL7764898 0.88 LMNA (0.64) LMNASMN1; SMN2
SCHEMBL14181569 0.88 LMNA (0.41) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL7076147 0.87 LMNA (0.39) LMNA
SCHEMBL7581409 0.86 LMNA (0.42) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL7581413 0.86 LMNA (0.42) LMNAHDAC3HDAC4HDAC1HDAC7
Hydrochloric Acid SCHEMBL7581432 0.85 LMNA (0.41) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL6879887 0.85 LMNA (0.40) LMNATSHRKLK7
SCHEMBL5356462 0.85 LMNA (0.40) LMNATSHRKLK7
Hydrochloric Acid SCHEMBL7071547 0.85 LMNA (0.41) LMNAHDAC3HDAC4HDAC1HDAC7
SCHEMBL5482338 0.85 LMNA (0.40) LMNATSHRKLK7

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
JP-10007636-A None JP disclosed
JP-H107636-A PRODUCTION OF INTERMEDIATE USEFUL FOR SYNTHESIZING IODIDE CONTRAST MEDIUM ZAMBON GROUP SPA 1998-01-13 JP disclosed