SCHEMBL28131846

SCHEMBL28131846

CN1c2ccccc2SC1C(=O)C1Sc2ccccc2N1C

nearest known ligand 0.46

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ NOX1 Q9Y5S8 2/20 0.42
▸ BCHE P06276 8/20 0.41
▸ MAOA P21397 1/20 0.39
▸ GSK3B P49841 1/20 0.39
▸ ACHE P22303 2/20 0.39
▸ LMNA P02545 2/20 0.38
▸ HDAC4 P56524 1/20 0.38
▸ HDAC7 Q8WUI4 1/20 0.38
▸ HDAC5 Q9UQL6 1/20 0.38
▸ MEN1 O00255 1/20 0.38
▸ KMT2A Q03164 1/20 0.38
▸ MAPT P10636 1/20 0.37
▸ MAPK1 P28482 1/20 0.37
▸ TDP1 Q9NUW8 1/20 0.37
▸ L3MBTL1 Q9Y468 1/20 0.37
▸ NOTUM Q6P988 1/20 0.37
▸ SMN1; SMN2 Q16637 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
SCHEMBL28168110 0.87 NOX1 (0.41) NOX1BCHEMAOAGSK3BACHE
SCHEMBL19675523 0.87 NOX1 (0.44) NOX1BCHEMAOAGSK3BACHE
Hydrochloric Acid SCHEMBL28771874 0.84 BCHE (0.42) NOX1BCHEMAOAGSK3BACHE
SCHEMBL32662573 0.75 MAOA (0.43) NOX1BCHEMAOAGSK3BACHE
SCHEMBL12264201 0.74 MAOA (0.46) NOX1BCHEMAOAGSK3BMEN1
SCHEMBL29814962 0.72 MAOA (0.45) NOX1BCHEMAOAGSK3BMEN1
SCHEMBL16728889 0.72 MAOA (0.45) NOX1BCHEMAOAGSK3BMEN1
SCHEMBL347425 0.72 MAOA (0.45) NOX1BCHEMAOAGSK3BMEN1
SCHEMBL27438318 0.72 MAOA (0.41) NOX1BCHEMAOAGSK3BACHE
SCHEMBL27516784 0.72 MAOA (0.41) NOX1BCHEMAOAGSK3BSMN1; SMN2

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
CN-106461682-B The enzymatic of HbA1c measures 德赛诊断系统有限公司 2018-09-21 — — CN disclosed
CN-106461682-A Enzymatic determination of hba1c 德赛诊断系统有限公司 2017-02-22 — — CN disclosed
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