SCHEMBL28358175

SCHEMBL28358175

O=C(O)CC(F)(C(F)(F)F)C(F)(F)F

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ACLY P53396 3/20 0.44
ALDH1A1 P00352 2/20 0.41
HMGCR P04035 1/20 0.41
CHRM1 P11229 1/20 0.41
TBXA2R P21731 1/20 0.41
ADRA1A P35348 1/20 0.41
CYP2C19 P33261 2/20 0.39
HIF1A Q16665 2/20 0.39
CYP2D6 P10635 1/20 0.39
TSHR P16473 1/20 0.39
CPT2 P23786 2/20 0.35
TDP1 Q9NUW8 2/20 0.35
KDM4E B2RXH2 1/20 0.35
FFAR1 O14842 1/20 0.35
TET2 Q6N021 1/20 0.34
THRB P10828 1/20 0.32
LDHA P00338 1/20 0.32
SRR Q9GZT4 1/20 0.32
LMNA P02545 1/20 0.32
ALKBH5 Q6P6C2 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
SCHEMBL12980428 0.76 HMGCR (0.39) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL865358 0.75 ACLY (0.44) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL4643961 0.75 ACLY (0.44) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL12979090 0.75 THRB (0.39) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL25772273 0.73 ACLY (0.48) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL9438232 0.73 ACLY (0.48) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL185832 0.73
SCHEMBL12980434 0.73 THRB (0.43) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL11509869 0.73 HMGCR (0.52) ACLYALDH1A1HMGCRCHRM1TBXA2R
SCHEMBL8466961 0.73 ACLY (0.48) ACLYALDH1A1HMGCRCHRM1TBXA2R

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20250276924-A1 CHEMICAL AND BIOLOGICAL DEGRADATION OF ETHER PER- AND POLYFLUOROALKYL SUBSTANCES THE REGENTS OF THE UNIVERSITY OF CALIFORNIA 2025-09-04 US disclosed
CN-110869338-A Oxidation of alkanes to alkenes 斯克利普斯研究所 2020-03-06 CN disclosed
CN-110831916-A Direct oxidation of olefins to oxygenates 斯克利普斯研究所 2020-02-21 CN 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-20250276924-A1 CHEMICAL AND BIOLOGICAL DEGRADATION OF ETHER PER- AND POLYFLUOROALKYL SUBSTANCES PFAS, FGB, PFKFB1 ACLY 1271/4885ALDH1A1 715/4885HMGCR 3882/4885

“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.