SCHEMBL4606005

SCHEMBL4606005

O=C(OF)c1ccc2ccccc2n1

nearest known ligand 0.61

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
MGAM O43451 1/20 0.61
MAPT P10636 4/20 0.57
KDM4E B2RXH2 5/20 0.56
SMN1; SMN2 Q16637 3/20 0.56
CNR2 P34972 4/20 0.56
HDAC8 Q9BY41 1/20 0.56
ALDH1A1 P00352 4/20 0.54
GAA P10253 2/20 0.54
KMT2A Q03164 2/20 0.54
NFKB1 P19838 1/20 0.51
RAB9A P51151 1/20 0.51
NFKB2 Q00653 1/20 0.51
RELA Q04206 1/20 0.51
HTT P42858 1/20 0.50
MEN1 O00255 1/20 0.50
L3MBTL1 Q9Y468 1/20 0.50
HPGD P15428 1/20 0.49

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
SCHEMBL3954441 0.85 MGAM (0.66) MGAMMAPTKDM4ESMN1; SMN2CNR2
SCHEMBL5176927 0.83 MGAM (0.63) MGAMMAPTKDM4ESMN1; SMN2CNR2
SCHEMBL6955948 0.83 MGAM (0.63) MGAMMAPTKDM4ESMN1; SMN2CNR2
SCHEMBL4302912 0.81 MGAM (0.61) MGAMMAPTKDM4ESMN1; SMN2CNR2
SCHEMBL30208641 0.81 MGAM (0.61) MGAMMAPTKDM4ESMN1; SMN2CNR2
SCHEMBL27643442 0.81 MAPT (0.61) MGAMMAPTKDM4ESMN1; SMN2CNR2
SCHEMBL28990407 0.81 MGAM (0.61) MGAMMAPTKDM4ESMN1; SMN2CNR2
SCHEMBL725183 0.81 MGAM (0.61) MGAMMAPTKDM4ESMN1; SMN2CNR2
SCHEMBL28908992 0.81 MAPT (0.61) MGAMMAPTKDM4ESMN1; SMN2CNR2
SCHEMBL4304080 0.81 SMN1; SMN2 (0.57) MGAMMAPTKDM4ESMN1; SMN2CNR2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
CN-110868861-B Agricultural compositions 萨卡帕·瓦达卡库塔 2022-03-15 CN disclosed
CN-111868024-B Phenoxy urea compound and pest control agent 日本曹达株式会社 2021-08-20 CN disclosed
CN-108697081-B Molecules having pesticidal utility, and intermediates, compositions and methods related thereto 美国陶氏益农公司 2021-07-23 CN disclosed
CN-111936469-A (hetero) arylsulfonamide compound and pest control agent 日本曹达株式会社 2020-11-13 CN disclosed
EP-1943234-A1 TRIAZOLE COMPOUNDS AS LIPOXYGENASE INHIBITORS Biolipox AB (SE) 2008-07-16 EP disclosed
WO-2007051982-A1 TRIAZOLE COMPOUNDS AS LIPOXYGENASE INHIBITORS BIOLIPOX AB (SE) 2007-05-10 WO disclosed