SCHEMBL8024329

SCHEMBL8024329

CC(O)Nc1cccc(N=Nc2ccccc2)c1[N+](=O)[O-]

nearest known ligand 0.37

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ MAPT P10636 7/20 0.36
▸ MAPK1 P28482 3/20 0.36
▸ TDP1 Q9NUW8 2/20 0.36
▸ L3MBTL1 Q9Y468 2/20 0.36
▸ NPSR1 Q6W5P4 1/20 0.36
▸ RAB9A P51151 5/20 0.36
▸ NPC1 O15118 4/20 0.36
▸ MEN1 O00255 4/20 0.36
▸ KMT2A Q03164 4/20 0.36
▸ HTT P42858 2/20 0.35
▸ CHRM1 P11229 1/20 0.35
▸ LMNA P02545 4/20 0.35
▸ ALDH1A1 P00352 4/20 0.35
▸ GAA P10253 1/20 0.35
▸ SMN1; SMN2 Q16637 3/20 0.33
▸ GRIN2D O15399 1/20 0.33
▸ GRIN3B O60391 1/20 0.33
▸ GRIN1 Q05586 1/20 0.33
▸ GRIN2A Q12879 1/20 0.33
▸ GRIN2B Q13224 1/20 0.33

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
SCHEMBL10397258 0.81 MAPT (0.42) MAPTL3MBTL1RAB9ANPC1MEN1
SCHEMBL8024333 0.77 KMT2A (0.40) MAPTTDP1RAB9ANPC1MEN1
SCHEMBL125385 0.75 ALDH1A1 (0.56) MAPTTDP1L3MBTL1RAB9AMEN1
SCHEMBL9258251 0.75 GPR35 (0.50) MAPTMAPK1TDP1L3MBTL1NPSR1
SCHEMBL18037665 0.75 GPR35 (0.50) MAPTMAPK1TDP1L3MBTL1NPSR1
SCHEMBL28220369 0.73 GPR35 (0.47) MAPTTDP1RAB9ANPC1MEN1
SCHEMBL8024323 0.72 MAPT (0.35) MAPTMAPK1TDP1L3MBTL1NPSR1
SCHEMBL28233524 0.72 GRIN2D (0.41) MAPTMAPK1TDP1L3MBTL1NPSR1
SCHEMBL27614713 0.72 PMM2 (0.46) MAPTMAPK1TDP1L3MBTL1NPSR1
SCHEMBL6129304 0.72 MEN1 (0.44) MAPTMAPK1TDP1L3MBTL1RAB9A

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
WO-2000054103-A1 CHIRAL POLYMER COMPOSITIONS EXHIBITING NONLINEAR OPTICAL PROPERTIES MOLECULAR OPTOELECTRONICS CORPORATION (US) 2000-09-14 — — WO disclosed
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