SCHEMBL31316899

SCHEMBL31316899

CN(C)C(=O)c1cccc(-n2ccc([N+](=O)[O-])n2)c1

nearest known ligand 0.45

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
F2 P00734 2/20 0.45
PLAU P00749 2/20 0.45
KLKB1 P03952 2/20 0.45
ELANE P08246 2/20 0.45
L3MBTL1 Q9Y468 3/20 0.44
ALDH1A1 P00352 5/20 0.43
ERN1 O75460 2/20 0.43
PMM2 O15305 1/20 0.41
MPI P34949 1/20 0.41
PHOSPHO1 Q8TCT1 1/20 0.41
KEAP1 Q14145 2/20 0.38
NFE2L2 Q16236 2/20 0.38
POLB P06746 3/20 0.38
HTT P42858 1/20 0.38
TP53 P04637 1/20 0.38
LMNA P02545 2/20 0.37
MEN1 O00255 2/20 0.36
KMT2A Q03164 2/20 0.36
KDM4E B2RXH2 2/20 0.36
MAPT P10636 2/20 0.36

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
SCHEMBL31316872 0.84 L3MBTL1 (0.56) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316911 0.82 TP53 (0.54) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316890 0.82 F2 (0.45) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316889 0.79 PMM2 (0.44) ERN1PMM2MPIPHOSPHO1KEAP1
SCHEMBL31316781 0.77 ALDH1A1 (0.45) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316906 0.75 LMNA (0.56) L3MBTL1KEAP1NFE2L2LMNAMEN1
SCHEMBL31316765 0.74 F2 (0.44) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316760 0.73 CHRNB2 (0.60) ALDH1A1KEAP1NFE2L2LMNAKDM4E
SCHEMBL7114840 0.73 F2 (0.53) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316818 0.72 F2 (0.50) F2PLAUKLKB1ELANEL3MBTL1

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
EP-4743453-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION Pretzel Therapeutics, Inc. (US) 2026-05-20 EP disclosed
WO-2025015178-A1 MODULATORS OF MITOCHONDRIAL DNA REPLICATION PRETZEL THERAPEUTICS, INC. (US) 2025-01-16 WO disclosed