SCHEMBL28612937

SCHEMBL28612937

CCC(=O)Oc1c(OC)ccnc1C(N)=O

nearest known ligand 0.40

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 5/20 0.40
MAPK1 P28482 1/20 0.38
GSK3B P49841 2/20 0.38
APAF1 O14727 1/20 0.36
NSD2 O96028 1/20 0.36
CASP3 P42574 1/20 0.36
SENP8 Q96LD8 1/20 0.36
SENP7 Q9BQF6 1/20 0.36
SENP6 Q9GZR1 1/20 0.36
L3MBTL1 Q9Y468 1/20 0.36
BPTF Q12830 1/20 0.36
ALDH1A1 P00352 2/20 0.35
SMN1; SMN2 Q16637 2/20 0.35
NPC1 O15118 1/20 0.34
RAB9A P51151 1/20 0.34
FGFR1 P11362 1/20 0.34
VCP P55072 1/20 0.34
POLB P06746 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
SCHEMBL29654861 0.87 KDM4E (0.38) IKBKBAPAF1NSD2CASP3SENP8
SCHEMBL23249392 0.87 KDM4E (0.38) IKBKBAPAF1NSD2CASP3SENP8
SCHEMBL16508203 0.86 IKBKB (0.39) IKBKBMAPK1GSK3BAPAF1NSD2
SCHEMBL25022428 0.85 HPGD (0.39) IKBKBMAPK1GSK3BAPAF1NSD2
SCHEMBL20370179 0.85 IKBKB (0.39) IKBKBMAPK1GSK3BAPAF1NSD2
SCHEMBL14159748 0.85 NPC1 (0.40) IKBKBMAPK1GSK3BAPAF1NSD2
SCHEMBL23746450 0.84 FGFR1 (0.36) IKBKBMAPK1GSK3BAPAF1NSD2
SCHEMBL21976891 0.84 IKBKB (0.43) IKBKBMAPK1GSK3BAPAF1NSD2
SCHEMBL25022762 0.83 MAPK1 (0.40) IKBKBMAPK1GSK3BAPAF1NSD2
Hydrochloric Acid SCHEMBL5008136 0.82 IKBKB (0.46) IKBKBMAPK1GSK3BAPAF1NSD2

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 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-113615696-A Pyridine amide compounds having fungicidal activity 美国陶氏益农公司 2021-11-09 CN disclosed
CN-107205405-B Pyridine amide compounds having fungicidal activity 美国陶氏益农公司 2021-08-24 CN disclosed
CN-113173838-A Pyridine amide compounds having fungicidal activity 美国陶氏益农公司 2021-07-27 CN disclosed
CN-107205386-B Pyridinamides with fungicidal activity 美国陶氏益农公司 2021-07-23 CN disclosed
CN-107207414-B Pyridine amide compounds having fungicidal activity 美国陶氏益农公司 2021-03-30 CN disclosed