SCHEMBL31473179

SCHEMBL31473179

Nc1ccc2nc3cc([N+](=O)[O-])ccc3cc2c1

nearest known ligand 0.52

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MEN1 O00255 3/20 0.52
KMT2A Q03164 3/20 0.52
LMNA P02545 3/20 0.52
F2 P00734 1/20 0.52
CHRM2 P08172 1/20 0.52
HTR1A P08908 1/20 0.52
ADRA2A P08913 1/20 0.52
ADORA3 P0DMS8 1/20 0.52
MAOA P21397 1/20 0.52
DRD1 P21728 1/20 0.52
ACHE P22303 1/20 0.52
PTGS1 P23219 1/20 0.52
SLC6A2 P23975 1/20 0.52
SLC6A4 P31645 1/20 0.52
OPRM1 P35372 1/20 0.52
DRD3 P35462 1/20 0.52
KDR P35968 1/20 0.52
HTT P42858 1/20 0.52
SLC6A3 Q01959 1/20 0.52
KCNH2 Q12809 1/20 0.52

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
SCHEMBL32690191 0.80 RAB9A (0.62) MEN1KMT2ALMNAACHEHTT
SCHEMBL8686325 0.79 ALDH1A1 (0.61) MEN1KMT2ALMNAHTTMAPT
SCHEMBL5394789 0.79 KMT2A (0.82) MEN1KMT2ALMNAF2CHRM2
SCHEMBL31473182 0.79 KMT2A (0.82) MEN1KMT2ALMNAF2CHRM2
SCHEMBL3828629 0.78 ALDH1A1 (0.59) MEN1KMT2ALMNAHTTMAPT
SCHEMBL29253977 0.78 ALDH1A1 (0.50) MEN1KMT2ALMNAMAPTRAB9A
SCHEMBL1438861 0.77 PLAU (0.53) SLC6A4HTR3AALDH1A1TDP1CYP3A4
SCHEMBL11059195 0.76 GUCY1B2 (0.54) MEN1KMT2AMAPTRAB9ANFKB1
SCHEMBL29711628 0.75 KMT2A (0.64) MEN1KMT2ALMNAF2CHRM2
SCHEMBL1230212 0.75 KMT2A (0.64) MEN1KMT2ALMNAF2CHRM2

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
CN-119390650-A Preparation method of diamine monomer containing acridone unit 东华大学 2025-02-07 CN disclosed