SCHEMBL28664013

SCHEMBL28664013

COc1cc([N+](=O)[O-])c(NC(C)=O)cc1[N+](=O)[O-]

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MAPT P10636 4/20 0.51
NPSR1 Q6W5P4 2/20 0.51
ALDH1A1 P00352 6/20 0.51
LMNA P02545 2/20 0.51
SMN1; SMN2 Q16637 2/20 0.51
GALR2 O43603 1/20 0.51
MITF O75030 1/20 0.51
POLB P06746 1/20 0.51
HSP90AA1 P07900 1/20 0.51
HPGD P15428 1/20 0.51
XBP1 P17861 1/20 0.51
CCR6 P51684 1/20 0.51
KMT2A Q03164 2/20 0.49
HTT P42858 2/20 0.49
CYP3A4 P08684 1/20 0.46
TSHR P16473 1/20 0.46
TDP1 Q9NUW8 1/20 0.46
NQO2 P16083 1/20 0.45
MTNR1A P48039 1/20 0.45
MTNR1B P49286 1/20 0.45

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
SCHEMBL9396485 0.92 MAPT (0.52) MAPTNPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL31423349 0.89 ALDH1A1 (0.56) MAPTNPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL2205405 0.88 LMNA (0.55) MAPTNPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL13811009 0.88 NPSR1 (0.49) MAPTNPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL29784832 0.88 LMNA (0.55) MAPTNPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL5953169 0.88 KMT2A (0.50) MAPTNPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL4346832 0.87 MAPT (0.49) MAPTNPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL13832507 0.87 ALDH1A1 (0.48) MAPTNPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL1646147 0.87 MAPT (0.48) MAPTNPSR1ALDH1A1LMNASMN1; SMN2
SCHEMBL18306153 0.87 MAPT (0.48) MAPTNPSR1ALDH1A1LMNASMN1; 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113651713-B Synthesis method of high-purity 2-nitro-4-acetamido anisole 宁夏中盛新科技有限公司 2024-05-14 CN disclosed
CN-113651713-A Synthesis method of high-purity 2-nitro-4-acetamino anisole 宁夏中盛新科技有限公司 2021-11-16 CN disclosed