Fluoride

Fluoride

SCHEMBL9841806

CCCC1CCC(C2CCC(Sc3ccccc3)CC2)CC1.F.F.F.F.F

nearest known ligand 0.41

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CARM1 Q86X55 1/20 0.41
PRMT6 Q96LA8 1/20 0.41
TLR4 O00206 2/20 0.35
HRH3 Q9Y5N1 1/20 0.35
CYP2C9 P11712 1/20 0.33
OPRL1 P41146 3/20 0.32
OPRM1 P35372 2/20 0.32
OPRK1 P41145 1/20 0.32
MAPT P10636 3/20 0.32
MAPK1 P28482 2/20 0.32
ALDH1A1 P00352 1/20 0.32
LMNA P02545 1/20 0.32
MEN1 O00255 1/20 0.32
KMT2A Q03164 1/20 0.32
GAA P10253 1/20 0.32
SMN1; SMN2 Q16637 1/20 0.32
TDP1 Q9NUW8 1/20 0.32
GRIN1 Q05586 2/20 0.31
GRIN2B Q13224 2/20 0.31
DRD4 P21917 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
Fluoride SCHEMBL9842078 0.91 CARM1 (0.40) CARM1PRMT6HRH3CYP2C9MAPT
Fluoride SCHEMBL9842070 0.90 CARM1 (0.39) CARM1PRMT6HRH3CYP2C9MAPT
Fluoride SCHEMBL9841721 0.88 CARM1 (0.38) CARM1PRMT6HRH3MAPTMEN1
Fluoride SCHEMBL9841579 0.88 CARM1 (0.38) CARM1PRMT6HRH3MAPTMEN1
Fluoride SCHEMBL9841663 0.88 CARM1 (0.38) CARM1PRMT6HRH3MAPTMEN1
Fluoride SCHEMBL9841703 0.87 CARM1 (0.43) CARM1PRMT6MAPTALDH1A1GAA
Fluoride SCHEMBL9841325 0.86 CARM1 (0.42) CARM1PRMT6HRH3CYP2C9MAPT
Fluoride SCHEMBL9842093 0.84 CARM1 (0.41) CARM1PRMT6HRH3CYP2C9MAPT
Fluoride SCHEMBL9842012 0.83 CARM1 (0.40) CARM1PRMT6HRH3MAPTMEN1
Fluoride SCHEMBL9841535 0.83 CARM1 (0.40) CARM1PRMT6HRH3MAPTMEN1

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-5055223-A For use in liquid crystal display elements MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) 1991-10-08 US disclosed