SCHEMBL31316890

SCHEMBL31316890

CNC(=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 1/20 0.44
KMT2A Q03164 3/20 0.43
MEN1 O00255 2/20 0.43
HDAC8 Q9BY41 1/20 0.42
HDAC6 Q9UBN7 1/20 0.42
LMNA P02545 2/20 0.42
KAT6A Q92794 1/20 0.41
KDM4E B2RXH2 1/20 0.40
TDP1 Q9NUW8 1/20 0.40
ALDH1A1 P00352 2/20 0.40
HTT P42858 1/20 0.40
SMN1; SMN2 Q16637 1/20 0.39
CHEK2 O96017 1/20 0.39
MAPT P10636 1/20 0.39
AOC2 O75106 1/20 0.38
KEAP1 Q14145 1/20 0.38

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
SCHEMBL31316911 0.85 TP53 (0.54) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316872 0.84 L3MBTL1 (0.56) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316940 0.84 F2 (0.47) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316899 0.82 F2 (0.45) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316903 0.79 MEN1 (0.50) KMT2AMEN1HDAC8HDAC6KAT6A
SCHEMBL31316781 0.77 ALDH1A1 (0.45) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316906 0.75 LMNA (0.56) L3MBTL1KMT2AMEN1LMNASMN1; SMN2
SCHEMBL31316916 0.73 KMT2A (0.40) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL7114840 0.73 F2 (0.53) F2PLAUKLKB1ELANEL3MBTL1
SCHEMBL31316757 0.72 KEAP1 (0.41) F2PLAUKLKB1ELANEKMT2A

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