SCHEMBL8150367

SCHEMBL8150367

Nc1c([N+](=O)[O-])c(Cc2ccccc2)nc2cccnc12

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
MGMT P16455 3/20 0.41
NPY1R P25929 3/20 0.40
MEN1 O00255 2/20 0.39
KMT2A Q03164 2/20 0.39
GAA P10253 2/20 0.39
PKM P14618 1/20 0.39
TOP1 P11387 1/20 0.39
MAPT P10636 4/20 0.38
HTT P42858 2/20 0.38
HPGD P15428 2/20 0.38
LMNA P02545 2/20 0.38
PDE10A Q9Y233 1/20 0.38
KDM4E B2RXH2 1/20 0.37
ALDH1A1 P00352 1/20 0.37
HSD17B10 Q99714 1/20 0.37
NPC1 O15118 1/20 0.36
RAB9A P51151 1/20 0.36
MAPK1 P28482 1/20 0.36
CA1 P00915 1/20 0.36
CA2 P00918 1/20 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
SCHEMBL4376577 0.81 EGFR (0.42) GAATOP1HTTHPGDKDM4E
SCHEMBL3354479 0.81 MAPT (0.40) MGMTNPY1RMEN1KMT2ATOP1
SCHEMBL311056 0.81 MGMT (0.59) MGMTMEN1KMT2AMAPTLMNA
SCHEMBL191388 0.80 MAPT (0.40) MGMTNPY1RMEN1KMT2AGAA
SCHEMBL8561208 0.78 HPGD (0.43) MGMTMEN1KMT2AGAAPKM
SCHEMBL3355146 0.74 MAPT (0.38) MGMTNPY1RMEN1KMT2AGAA
SCHEMBL3357601 0.74 TLR8 (0.38) MGMTNPY1RMEN1KMT2AMAPT
SCHEMBL6023201 0.72 MAPT (0.39) NPY1RMEN1KMT2AMAPTLMNA
SCHEMBL4378165 0.72 TLR8 (0.40) GAATOP1MAPTHPGDKDM4E
SCHEMBL8567046 0.72 HTT (0.47) MGMTNPY1RMEN1KMT2AMAPT

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-1040112-A1 IMIDAZONAPHTHYRIDINES AND THEIR USE IN INDUCING CYTOKINE BIOSYNTHESIS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 2000-10-04 EP disclosed
WO-1999029693-A1 IMIDAZONAPHTHYRIDINES AND THEIR USE IN INDUCING CYTOKINE BIOSYNTHESIS MINNESOTA MINING AND MANUFACTURING COMPANY (US) 1999-06-17 WO disclosed