Fluoride

Fluoride

SCHEMBL4453455

F.O=C1C2CC3CC1CC(CO)(C3)C2

nearest known ligand 0.46

Full drug profile on Sugi Atlas →

Predicted protein targets (top 16)

geneUniProtsupporting neighboursconfidence
EPHX2 P34913 9/20 0.46
ESR1 P03372 1/20 0.40
CYP2C9 P11712 1/20 0.40
ESR2 Q92731 1/20 0.40
TSHR P16473 2/20 0.39
NPSR1 Q6W5P4 1/20 0.39
ALDH1A1 P00352 4/20 0.35
HSD17B10 Q99714 1/20 0.34
LMNA P02545 1/20 0.33
GRIN2D O15399 1/20 0.32
GRIN3B O60391 1/20 0.32
GRIN1 Q05586 1/20 0.32
GRIN2A Q12879 1/20 0.32
GRIN2B Q13224 1/20 0.32
GRIN2C Q14957 1/20 0.32
GRIN3A Q8TCU5 1/20 0.32

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
SCHEMBL5090033 0.98 EPHX2 (0.47) EPHX2ESR1CYP2C9ESR2TSHR
Ethylene SCHEMBL3028191 0.79 EPHX2 (0.34) EPHX2ESR1CYP2C9ESR2TSHR
Fluoride SCHEMBL1394508 0.78 GRIN2D (0.50) EPHX2ESR1CYP2C9ESR2TSHR
SCHEMBL12256144 0.77 EPHX2 (0.40) EPHX2TSHRNPSR1GRIN2DGRIN3B
SCHEMBL3110039 0.77 EPHX2 (0.47) EPHX2TSHRNPSR1ALDH1A1
SCHEMBL5101830 0.76 EPHX2 (0.42) EPHX2TSHRNPSR1ALDH1A1HSD17B10
SCHEMBL25797414 0.75 GRIN2D (0.52) EPHX2ESR1CYP2C9ESR2TSHR
SCHEMBL236361 0.75 GRIN2D (0.52) EPHX2ESR1CYP2C9ESR2TSHR
SCHEMBL25797411 0.75 GRIN2D (0.52) EPHX2ESR1CYP2C9ESR2TSHR
SCHEMBL23185440 0.74 EPHX2 (0.41) EPHX2TSHRNPSR1HSD17B10GRIN2D

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
US-20090099326-A1 FLUORINE-CONTAINING ADAMANTANE DERIVATIVE, FLUORINE-CONTAINING ADAMANTANE DERIVATIVE HAVING POLYMERIZABLE GROUP, RESIN COMPOSITION CONTAINING THE SAME, AND ANTIREFLECTION FILM IDEMITSU KOSAN CO., LTD. (JP) 2009-04-16 US disclosed
EP-2014639-A1 FLUORINE-CONTAINING ADAMANTANE DERIVATIVE, FLUORINE-CONTAINING ADAMANTANE DERIVATIVE HAVING POLYMERIZABLE GROUP, RESIN COMPOSITION CONTAINING THE SAME, AND ANTIREFLECTION FILM Idemitsu Kosan Co., Ltd. (JP) 2009-01-14 EP disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20090099326-A1 FLUORINE-CONTAINING ADAMANTANE DERIVATIVE, FLUORINE-CONTAINING ADAMANTANE DERIVATIVE HAVING POLYMERIZABLE GROUP, RESIN COMPOSITION CONTAINING THE SAME, AND ANTIREFLECTION FILM ADGRF1, RFT1, AFF1 EPHX2 1783/4885ESR1 1936/4885CYP2C9 2325/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.