SCHEMBL16508183

SCHEMBL16508183

COc1ccnc(C(N)=O)c1OCOC(C)=O

nearest known ligand 0.39

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
IKBKB O14920 3/20 0.39
KDM4E B2RXH2 2/20 0.37
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
SMN1; SMN2 Q16637 2/20 0.35
GSK3B P49841 1/20 0.35
NPC1 O15118 1/20 0.35
MTNR1A P48039 1/20 0.35
MTNR1B P49286 1/20 0.35
MAPK1 P28482 1/20 0.35
MYC P01106 1/20 0.34
LMNA P02545 1/20 0.33
CYP1A2 P05177 1/20 0.33
PTPN1 P18031 1/20 0.33
IRAK4 Q9NWZ3 4/20 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
SCHEMBL19053406 0.89 MYC (0.36) IKBKBKDM4EAPAF1NSD2CASP3
SCHEMBL16258541 0.89 IKBKB (0.36) IKBKBKDM4EAPAF1NSD2CASP3
SCHEMBL16573133 0.88 IKBKB (0.39) IKBKBKDM4EAPAF1NSD2CASP3
SCHEMBL16508203 0.88 IKBKB (0.39) IKBKBKDM4EAPAF1NSD2CASP3
SCHEMBL16258544 0.86 IKBKB (0.38) IKBKBKDM4EAPAF1NSD2CASP3
SCHEMBL19604244 0.86 IKBKB (0.38) IKBKBKDM4EAPAF1NSD2CASP3
SCHEMBL16573170 0.85 IKBKB (0.37) IKBKBKDM4EAPAF1NSD2CASP3
SCHEMBL16573140 0.85 IKBKB (0.40) IKBKBKDM4EAPAF1NSD2CASP3
SCHEMBL16573179 0.85 IKBKB (0.37) IKBKBKDM4EAPAF1NSD2CASP3
SCHEMBL16573130 0.84 IKBKB (0.38) IKBKBKDM4EAPAF1NSD2CASP3

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-3565410-B1 PICOLINAMIDES AS FUNGICIDES CORTEVA AGRISCIENCE LLC (US) 2023-02-15 EP disclosed
CN-107205386-B Pyridinamides with fungicidal activity 美国陶氏益农公司 2021-07-23 CN disclosed
EP-3106461-B1 DERIVATIVES OF UK-2A DOW AGROSCIENCES LLC (US) 2020-05-06 EP disclosed
EP-3240419-B1 PICOLINAMIDE COMPOUNDS WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2020-05-06 EP disclosed
EP-3240408-B1 PICOLINAMIDES WITH FUNGICIDAL ACTIVITY DOW AGROSCIENCES LLC (US) 2020-04-08 EP disclosed
CN-107205386-A Pyridinamides with fungicidal activity 美国陶氏益农公司 2017-09-26 CN disclosed
CN-107105649-A Pyridinamides with fungicidal activity 美国陶氏益农公司 2017-08-29 CN disclosed
EP-3150595-A1 DERIVATIVES OF UK-2A DOW AGROSCIENCES LLC (US) 2017-04-05 EP disclosed
EP-2848616-B1 Derivatives of UK-2A DOW AGROSCIENCES LLC (US) 2016-11-23 EP disclosed
EP-2848616-A1 Derivatives of UK-2A Dow AgroSciences LLC (US) 2015-03-18 EP disclosed
EP-2527342-A2 Derivatives of UK-2A Dow AgroSciences LLC (US) 2012-11-28 EP disclosed