SCHEMBL30979237

SCHEMBL30979237

O=C(O)CC(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)C(F)(F)F

nearest known ligand 0.41

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.41
SLC22A6 Q4U2R8 1/20 0.32
TDP1 Q9NUW8 1/20 0.31
FOLH1 Q04609 1/20 0.30
SMN1; SMN2 Q16637 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
SCHEMBL1704335 0.82 SLC22A6 (0.38) SLC22A6TDP1FOLH1SMN1; SMN2
SCHEMBL6061456 0.81 TET2 (0.38) THRB
SCHEMBL7768142 0.81 TET2 (0.38) THRB
SCHEMBL7598977 0.79 THRB (0.41) THRBSLC22A6TDP1FOLH1SMN1; SMN2
SCHEMBL2222458 0.79 CYP2D6 (0.30)
SCHEMBL19307810 0.77
SCHEMBL7596870 0.76 CYP2D6 (0.31) SLC22A6
SCHEMBL6753018 0.75 THRB (0.38) THRB
SCHEMBL5713370 0.75 THRB (0.38) THRB
SCHEMBL26428032 0.75 THRB (0.32) THRB

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
CN-115754101-B Synchronous detection method for perfluoro and polyfluoroalkyl substances in urine 中山大学 2025-03-04 CN claimed
CN-115754101-B Synchronous detection method for perfluoro and polyfluoroalkyl substances in urine 中山大学 2025-03-04 CN disclosed
CN-118330092-A Synchronous detection method for full/polyfluoroalkyl substances in water sample 中山大学 2024-07-12 CN disclosed