SCHEMBL11340965

SCHEMBL11340965

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

nearest known ligand 0.56

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
LMNA P02545 6/20 0.53
APEX1 P27695 1/20 0.37
CYP2C19 P33261 1/20 0.35
HIF1A Q16665 1/20 0.35
SMN1; SMN2 Q16637 1/20 0.34
L3MBTL1 Q9Y468 1/20 0.32
RAB9A P51151 1/20 0.31
SOST Q9BQB4 1/20 0.30
HPGD P15428 1/20 0.30
PTPRB P23467 1/20 0.30
HSD17B10 Q99714 1/20 0.30
EGLN1 Q9GZT9 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
SCHEMBL11347525 0.85 LMNA (0.51) LMNAAPEX1CYP2C19HIF1ASMN1; SMN2
SCHEMBL9816334 0.85 LMNA (0.53) LMNAAPEX1HIF1ASMN1; SMN2L3MBTL1
Metrizoic Acid SCHEMBL29570734 0.82 LMNA (0.52) LMNASMN1; SMN2
Metrizoic Acid SCHEMBL37641 0.82 LMNA (0.52) LMNASMN1; SMN2
SCHEMBL11344450 0.82 APEX1 (0.39) LMNAAPEX1CYP2C19HIF1AL3MBTL1
Metrizoic Acid SCHEMBL1237887 0.81 LMNA (0.51) LMNASMN1; SMN2
Metrizoic Acid SCHEMBL1236887 0.81 LMNA (0.51) LMNASMN1; SMN2
SCHEMBL11700573 0.81 LMNA (0.58) LMNAAPEX1CYP2C19SMN1; SMN2L3MBTL1
SCHEMBL11694200 0.80 LMNA (0.47) LMNAAPEX1CYP2C19HIF1ASMN1; SMN2
SCHEMBL11690984 0.80 LMNA (0.47) LMNAAPEX1CYP2C19HIF1ASMN1; SMN2

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-4307072-A X-RAY CONTRAST AGENTS MALLINCKRODT, INC. (US) 1981-12-22 US disclosed