SCHEMBL5597220

SCHEMBL5597220

CCC(F)C(F)(F)OC(=O)CCCO

nearest known ligand 0.32

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
MAPT P10636 1/20 0.32
MAPK1 P28482 1/20 0.32
CAMK2A Q9UQM7 1/20 0.30
CYP3A4 P08684 1/20 0.30
TSHR P16473 1/20 0.30
ATM Q13315 1/20 0.30
TDP1 Q9NUW8 1/20 0.30
LMNA P02545 2/20 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
SCHEMBL5597431 0.69 MAPT (0.34) MAPTMAPK1LMNA
SCHEMBL6131445 0.69
SCHEMBL473225 0.69 TDP1 (0.47) CAMK2ATSHRTDP1
SCHEMBL9304290 0.68 TSHR (0.37) MAPK1CYP3A4TSHR
SCHEMBL9303668 0.68 TSHR (0.37) TSHR
Hydrochloric Acid SCHEMBL28201423 0.67 TDP1 (0.46) CAMK2ATSHRTDP1
SCHEMBL29108605 0.67 CAMK2A (0.39) MAPTMAPK1CAMK2ATSHRTDP1
SCHEMBL9134533 0.67 TSHR (0.31) MAPTMAPK1TSHR
SCHEMBL16837517 0.66 GPR84 (0.44) MAPTMAPK1TDP1LMNA
SCHEMBL9134217 0.66 TSHR (0.31) TSHRLMNA

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 4 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1403238-B1 PROCESS FOR PRODUCING FLUORINATED ALCOHOL TOSOH F TECH INC (JP) 2007-04-04 EP disclosed
US-6894197-B2 Reacting 4,4,4-trifluorobutylhalides with potassium salt of 4-hydroxybutyrate in gamma-butyrolactone solvents to form 4,4,4-trifluorobutanol; hydrolysis TOSOH F-TECH, INC. (JP) 2005-05-17 US disclosed
US-20040152926-A1 Process for producing fluorinated alcohol TOSOH F-TECH INC. (JP) 2004-08-05 US disclosed
EP-1403238-A1 PROCESS FOR PRODUCING FLUORINATED ALCOHOL Tosoh F-Tech, Inc. (JP) 2004-03-31 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-20040152926-A1 Process for producing fluorinated alcohol ADH1A, ADH1C, HSD17B10 MAPT 3804/4885MAPK1 1467/4885CAMK2A 2403/4885

“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.