SCHEMBL12087445

SCHEMBL12087445

CS(=O)(=O)ONc1ccccc1N=N

nearest known ligand 0.36

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
▸ GAA P10253 1/20 0.36
▸ L3MBTL1 Q9Y468 1/20 0.32
▸ KEAP1 Q14145 1/20 0.32
▸ GRIN2D O15399 1/20 0.30
▸ GRIN3B O60391 1/20 0.30
▸ GRIN1 Q05586 1/20 0.30
▸ GRIN2A Q12879 1/20 0.30
▸ GRIN2B Q13224 1/20 0.30
▸ GRIN2C Q14957 1/20 0.30
▸ GRIN3A Q8TCU5 1/20 0.30
▸ SIGMAR1 Q99720 1/20 0.30

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
SCHEMBL21227230 0.77 SIGMAR1 (0.39) GAAGRIN2DGRIN3BGRIN1GRIN2A
SCHEMBL13213707 0.77 GAA (0.58) GAAL3MBTL1KEAP1
SCHEMBL23982944 0.72 GRIN2D (0.31) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL19728622 0.71 MCOLN3 (0.49) L3MBTL1
SCHEMBL17372715 0.71 GRIN2D (0.32) GRIN2DGRIN3BGRIN1GRIN2AGRIN2B
SCHEMBL12740474 0.69 POLB (0.43) GAAL3MBTL1GRIN2DGRIN3BGRIN1
SCHEMBL22692581 0.68 — —
SCHEMBL17249489 0.68 — —
SCHEMBL31574184 0.68 ALDH1A1 (0.35) —
SCHEMBL9492832 0.67 KEAP1 (0.52) GAAL3MBTL1KEAP1

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-2495235-B1 Process for the synthesis of prostaglandins and intermediates thereof NEWCHEM S P A (IT) 2015-08-05 — — EP disclosed
EP-2495235-A1 Process for the synthesis of prostaglandins and intermediates thereof Newchem S.p.A. (IT) 2012-09-05 — — EP disclosed
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