Streptonigrin

Streptonigrin

SCHEMBL4636734

COC1=C(N)C(=O)c2nc(-c3nc(C(=O)O)c(C)c(-c4ccc(OC)c(OC)c4O)c3N)ccc2C1=O.c1ccc(-c2ccccn2)nc1

nearest known ligand 0.88

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
LMNA P02545 2/20 0.88
SMN1; SMN2 Q16637 2/20 0.88
PADI1 Q9ULC6 2/20 0.88
PADI3 Q9ULW8 2/20 0.88
PADI4 Q9UM07 2/20 0.88
PADI2 Q9Y2J8 2/20 0.88
KDM4E B2RXH2 2/20 0.88
KMT2A Q03164 2/20 0.88
NPC1 O15118 2/20 0.88
MAPT P10636 2/20 0.88
RAB9A P51151 2/20 0.88
MEN1 O00255 1/20 0.88
POLB P06746 1/20 0.88
TGM2 P21980 1/20 0.88
PDE4A P27815 1/20 0.88
MAPK1 P28482 1/20 0.88
GALK1 P51570 1/20 0.88
BLM P54132 1/20 0.88
PDE4B Q07343 1/20 0.88
PDE4C Q08493 1/20 0.88

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
Streptonigrin SCHEMBL3940 0.94 MAPT (1.00) LMNASMN1; SMN2PADI1PADI3PADI4
Streptonigrin SCHEMBL29821157 0.94 MAPT (1.00) LMNASMN1; SMN2PADI1PADI3PADI4
Streptonigrin SCHEMBL29371276 0.94 MAPT (1.00) LMNASMN1; SMN2PADI1PADI3PADI4
Streptonigrin SCHEMBL29374011 0.94 MAPT (1.00) LMNASMN1; SMN2PADI1PADI3PADI4
Streptonigrin SCHEMBL6299739 0.89 LMNA (0.84) LMNASMN1; SMN2PADI1PADI3PADI4
SCHEMBL25015126 0.87 MAPT (0.87) LMNASMN1; SMN2PADI1PADI3PADI4
SCHEMBL30260509 0.87 MAPT (0.87) LMNASMN1; SMN2PADI1PADI3PADI4
Streptonigrin SCHEMBL23421492 0.86 LMNA (0.85) LMNASMN1; SMN2PADI1PADI3PADI4
SCHEMBL23484220 0.83 FNTA (0.82) LMNASMN1; SMN2PADI1PADI3PADI4
SCHEMBL20257205 0.80 SMN1; SMN2 (0.75) LMNASMN1; SMN2PADI1PADI3PADI4

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
EP-1784220-A4 BACTERIAL IRON ACQUISITION TARGETS UNIV WESTERN ONTARIO (CA) 2008-06-25 EP disclosed
EP-1784220-A2 BACTERIAL IRON ACQUISITION TARGETS THE UNIVERSITY OF WESTERN ONTARIO (CA) 2007-05-16 EP disclosed
WO-2006021893-A2 PHARMACEUTICAL COMPOSITIONS COMPRISING INHIBITORS OF IRON TRANSPORT, AND METHOD OF IDENTIFYING IRON TRANSPORT INHIBITORS, FN STAPHYLOCOCCUS AUREUS THE UNIVERSITY OF WESTERN ONTARIO (CA) 2006-03-02 WO disclosed