SCHEMBL25199284

SCHEMBL25199284

NC(=O)c1ncc(F)c(F)c1F

nearest known ligand 0.38

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDM4E B2RXH2 2/20 0.38
ASPH Q12797 2/20 0.38
KDM8 Q8N371 2/20 0.38
IDO1 P14902 1/20 0.38
CES2 O00748 1/20 0.35
CES1 P23141 1/20 0.35
DGAT1 O75907 1/20 0.34
KMT2A Q03164 2/20 0.33
ADORA3 P0DMS8 1/20 0.33
TSHR P16473 1/20 0.33
MC4R P32245 1/20 0.33
ADRA1A P35348 1/20 0.33
MC3R P41968 1/20 0.33
SYK P43405 1/20 0.33
USP2 O75604 1/20 0.33
CDC7 O00311 1/20 0.33
MAPT P10636 1/20 0.33
HTT P42858 1/20 0.33
NNMT P40261 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32

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
SCHEMBL29137663 0.78 KDM4E (0.38) KDM4EASPHKDM8CES2CES1
SCHEMBL2696087 0.72 KDM4E (0.46) KDM4EASPHKDM8IDO1CES2
SCHEMBL5764489 0.72 CA1 (0.34) KDM4EASPHKDM8KMT2AADORA3
SCHEMBL30641925 0.72 DPP4 (0.39) IDO1KMT2ASYKUSP2
SCHEMBL4326940 0.72 DPP4 (0.39) IDO1KMT2ASYKUSP2
SCHEMBL17641569 0.71 IDO1 (0.36) KDM4EASPHKDM8IDO1DGAT1
Hydrochloric Acid SCHEMBL28375765 0.71 DPP4 (0.39) IDO1KMT2ASYKUSP2
SCHEMBL1584594 0.70 PARP1 (0.47) IDO1DGAT1SYKHTTSMN1; SMN2
Hydrochloric Acid SCHEMBL17633143 0.69 IDO1 (0.35) KDM4EASPHKDM8IDO1DGAT1
SCHEMBL18340314 0.69 LMNA (0.39) KMT2AMAPTNNMTSMN1; SMN2SIRT6

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023087410-A1 INSECTICIDAL COMPOSITION CONTAINING EMAMECTIN B2A BENZOATE 河北威远生物化工有限公司 2023-05-25 WO disclosed
CN-114052035-B Insecticidal composition containing emamectin benzoate B2a benzoate 河北威远生物化工有限公司 2022-07-29 CN disclosed
CN-114052035-A Insecticidal composition containing emamectin benzoate B2a benzoate 河北威远生物化工有限公司 2022-02-18 CN disclosed