Fluoride

Fluoride

SCHEMBL11207159

COC(=O)C(F)(F)C(F)(F)C(F)(F)C(=O)O.F

nearest known ligand 0.44

Full drug profile on Sugi Atlas →

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
THRB P10828 1/20 0.44
VCAM1 P19320 1/20 0.37
KCNN4 O15554 1/20 0.33
ALDH1A1 P00352 1/20 0.32
DGAT1 O75907 1/20 0.32
ACLY P53396 2/20 0.31
PTPN1 P18031 1/20 0.31
MAPT P10636 1/20 0.31
SRC P12931 1/20 0.31

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
SCHEMBL9502603 0.98 THRB (0.46) THRBVCAM1KCNN4ALDH1A1DGAT1
Fluoride SCHEMBL11206733 0.93 THRB (0.54) THRBVCAM1KCNN4ALDH1A1DGAT1
SCHEMBL29186298 0.93 THRB (0.52) THRBVCAM1KCNN4ALDH1A1DGAT1
SCHEMBL29186295 0.91 THRB (0.56) THRBVCAM1KCNN4ALDH1A1DGAT1
SCHEMBL517272 0.88 DGAT1 (0.39) THRBKCNN4ALDH1A1DGAT1MAPT
SCHEMBL22767945 0.83 ALDH1A1 (0.39) THRBKCNN4ALDH1A1DGAT1ACLY
SCHEMBL497763 0.83 DGAT1 (0.39) THRBKCNN4ALDH1A1DGAT1MAPT
SCHEMBL11205420 0.80 THRB (0.40) THRBKCNN4ALDH1A1DGAT1SRC
SCHEMBL3082673 0.80 THRB (0.40) THRBKCNN4ALDH1A1DGAT1SRC
SCHEMBL672362 0.80 THRB (0.40) THRBKCNN4ALDH1A1DGAT1SRC

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
US-4401829-A Process for the preparation of perfluorinated carboxylic acid fluorides HOECHST AKTIENGESELLSCHAFT (DE) 1983-08-30 US disclosed