SCHEMBL30724548

SCHEMBL30724548

Nc1c([N+](=O)[O-])nn([N+](=O)[O-])c1[N+](=O)[O-]

nearest known ligand 0.32

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
PKM P14618 1/20 0.32

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
SCHEMBL28507244 0.78 PKM (0.32) PKM
SCHEMBL29018436 0.78 PKM (0.32) PKM
SCHEMBL7780473 0.76 PKM (0.43) PKM
SCHEMBL29091845 0.76
SCHEMBL18420239 0.74 LMNA (0.35) PKM
SCHEMBL28903969 0.72 LMNA (0.33)
SCHEMBL31603040 0.72 KDM4E (0.36)
SCHEMBL28849782 0.67 L3MBTL1 (0.38)
SCHEMBL29171229 0.67 MEN1 (0.31)
SCHEMBL4561816 0.64 ALDH1A1 (0.46) PKM

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-117362232-A High-energy nitro-imitation compound for improving oxygen balance of 4-amino-3, 5-dinitropyrazole and synthesis method thereof 南京理工大学 2024-01-09 CN disclosed