SCHEMBL26089487

SCHEMBL26089487

O=C(C(Br)Br)C(F)(F)F.O=C(C(Br)Br)C(F)(F)F

nearest known ligand 0.39

Predicted protein targets (top 11)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 3/20 0.39
THRB P10828 1/20 0.39
RECQL P46063 1/20 0.39
CA2 P00918 1/20 0.38
GSK3B P49841 1/20 0.34
POLB P06746 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
MEN1 O00255 1/20 0.31
KMT2A Q03164 1/20 0.31
CYP2C19 P33261 1/20 0.30
HSD17B10 Q99714 1/20 0.30

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
SCHEMBL216366 1.00
Water SCHEMBL21725015 0.97 ALDH1A1 (0.37) ALDH1A1THRBRECQLCA2GSK3B
SCHEMBL6906960 0.78
SCHEMBL5860801 0.78
SCHEMBL15293930 0.75 THRB (0.35) ALDH1A1THRBRECQLGSK3B
SCHEMBL4758128 0.75
SCHEMBL11635042 0.75
SCHEMBL1135458 0.75
SCHEMBL2650133 0.75
SCHEMBL28130620 0.75

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
WO-2023066783-A1 HERBICIDAL IMIDAZOLE COMPOUNDS SYNGENTA CROP PROTECTION AG (CH) 2023-04-27 WO disclosed