SCHEMBL11274120

SCHEMBL11274120

O=Nc1ccc(N=O)c(N=O)c1N=O

nearest known ligand 0.40

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ HSP90AA1 P07900 1/20 0.40
▸ GRIN2D O15399 1/20 0.31
▸ GRIN3B O60391 1/20 0.31
▸ GRIN1 Q05586 1/20 0.31
▸ GRIN2A Q12879 1/20 0.31
▸ GRIN2B Q13224 1/20 0.31
▸ GRIN2C Q14957 1/20 0.31
▸ GRIN3A Q8TCU5 1/20 0.31
▸ KDM4E B2RXH2 1/20 0.31
▸ NPC1 O15118 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.31
▸ MAPT P10636 1/20 0.31
▸ XBP1 P17861 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ NPSR1 Q6W5P4 1/20 0.31
▸ TDP1 Q9NUW8 1/20 0.31
▸ L3MBTL1 Q9Y468 1/20 0.31

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
SCHEMBL12123913 0.80 HSP90AA1 (0.42) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL4367127 0.78 CYP1A2 (0.42) HSP90AA1KDM4EALDH1A1MAPTNPSR1
SCHEMBL9545953 0.76 HSP90AA1 (0.31) HSP90AA1
SCHEMBL11230056 0.76 HSP90AA1 (0.33) HSP90AA1MAPT
SCHEMBL11221712 0.76 GRIN2D (0.40) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL1275863 0.72 HSP90AA1 (0.47) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL9860043 0.72 KDM4E (0.38) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL11232182 0.70 GRIN2D (0.40) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL19050286 0.70 HSP90AA1 (0.40) HSP90AA1GRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL3401567 0.70 HSP90AA1 (0.35) HSP90AA1

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
JP-57084563-A — — None — — JP disclosed
JP-S5784563-A BATTERY MATSUSHITA ELECTRIC IND CO LTD 1982-05-26 — — JP disclosed
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