Fluoride

Fluoride

SCHEMBL6355463

F.O=[N+]([O-])c1cc(C(F)(F)F)ccc1F

nearest known ligand 0.62

Full drug profile on Sugi Atlas →

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 5/20 0.56
HIF1A Q16665 2/20 0.56
CYP3A4 P08684 1/20 0.55
HPGD P15428 1/20 0.55
ALOX15 P16050 1/20 0.55
TSHR P16473 1/20 0.55
TXNRD1 Q16881 1/20 0.55
TXNRD3 Q86VQ6 1/20 0.55
TXNRD2 Q9NNW7 1/20 0.55
TDP1 Q9NUW8 1/20 0.55
VCAM1 P19320 1/20 0.53
EPAS1 Q99814 1/20 0.52
MAPK1 P28482 2/20 0.50
MAPT P10636 3/20 0.49
LMNA P02545 1/20 0.49
MEN1 O00255 1/20 0.48
KMT2A Q03164 1/20 0.48
GAA P10253 1/20 0.48
HPD P32754 2/20 0.47
MASP2 O00187 1/20 0.47

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
SCHEMBL29430691 0.98 ALDH1A1 (0.58) ALDH1A1HIF1ACYP3A4HPGDALOX15
SCHEMBL5961 0.98 ALDH1A1 (0.58) ALDH1A1HIF1ACYP3A4HPGDALOX15
Methyl Alcohol SCHEMBL28966984 0.93 ALDH1A1 (0.53) ALDH1A1HIF1ACYP3A4HPGDALOX15
SCHEMBL4638626 0.87 ALDH1A1 (0.58) ALDH1A1HIF1ACYP3A4HPGDALOX15
SCHEMBL19878494 0.84 ALDH1A1 (0.55) ALDH1A1HIF1ACYP3A4HPGDALOX15
SCHEMBL29739317 0.84 ALDH1A1 (0.55) ALDH1A1HIF1ACYP3A4HPGDALOX15
SCHEMBL29836953 0.84 ALDH1A1 (0.55) ALDH1A1HIF1ACYP3A4HPGDALOX15
SCHEMBL19878569 0.84 ALDH1A1 (0.55) ALDH1A1HIF1ACYP3A4HPGDALOX15
SCHEMBL113070 0.83 TDP1 (0.60) ALDH1A1HIF1ACYP3A4HPGDALOX15
SCHEMBL29580528 0.83 TDP1 (0.60) ALDH1A1HIF1ACYP3A4HPGDALOX15

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-20050282812-A1 Inhibitors of cholesteryl ester transfer protein ARRAY BIOPHARMA INC. 2005-12-22 US 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-20050282812-A1 Inhibitors of cholesteryl ester transfer protein CETP, LCAT, MTTP ALDH1A1 2949/4885HIF1A 3002/4885CYP3A4 1369/4885

“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.