SCHEMBL29908006

SCHEMBL29908006

O=C(O)c1c(Br)c(C(F)(F)F)cc(C(F)(F)F)c1Br

nearest known ligand 0.41

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
GLRA3 O75311 1/20 0.41
GLRB P48167 1/20 0.41
TAS2R14 Q9NYV8 3/20 0.39
ASPH Q12797 1/20 0.39
ACP1 P24666 1/20 0.36
NOTUM Q6P988 1/20 0.36
LMNA P02545 2/20 0.36
MEN1 O00255 1/20 0.36
MAPT P10636 1/20 0.36
KMT2A Q03164 1/20 0.36
TMPRSS4 Q9NRS4 1/20 0.36
ALKBH5 Q6P6C2 1/20 0.36
DAO P14920 1/20 0.35
CES2 O00748 2/20 0.34
GPR35 Q9HC97 1/20 0.34
EPRS1 P07814 1/20 0.34
HTT P42858 1/20 0.33
SMN1; SMN2 Q16637 1/20 0.33
ANO1 Q5XXA6 1/20 0.33
TSHR P16473 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
SCHEMBL22866505 0.80 TAS2R14 (0.36) GLRA3GLRBTAS2R14ASPHACP1
SCHEMBL4171508 0.78 EPRS1 (0.43) GLRA3GLRBTAS2R14ASPHACP1
SCHEMBL22207903 0.76 TAS2R14 (0.42) TAS2R14NOTUMLMNADAOCES2
SCHEMBL29244561 0.75 TAS2R14 (0.38) TAS2R14ASPHACP1NOTUMLMNA
SCHEMBL26120541 0.72 TAS2R14 (0.34) TAS2R14ASPHNOTUMLMNAMEN1
SCHEMBL23388111 0.72 ASPH (0.42) TAS2R14ASPHNOTUMTMPRSS4ALKBH5
SCHEMBL22114832 0.71 ASPH (0.40) GLRA3GLRBASPHNOTUMDAO
SCHEMBL3369693 0.71 CES2 (0.48) ASPHNOTUMLMNACES2GPR35
SCHEMBL28053969 0.71 RXRA (0.41) GLRA3GLRBASPHLMNAMEN1
SCHEMBL16636939 0.71 EPRS1 (0.39) TAS2R14ASPHNOTUMDAOGPR35

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-115003663-B Novel heteroaryl-triazole compounds as pesticides 拜耳公司 2024-04-30 CN disclosed
CN-115003663-A Novel heteroaryl-triazole compounds as pesticides 拜耳公司 2022-09-02 CN disclosed