SCHEMBL2628192

SCHEMBL2628192

CC(=O)Cc1ccc(OCCF)cc1

nearest known ligand 0.58

Predicted protein targets (top 15)

geneUniProtsupporting neighboursconfidence
ALDH1A1 P00352 1/20 0.58
POLB P06746 1/20 0.54
APP P05067 4/20 0.53
TSPO P30536 1/20 0.52
KDM4E B2RXH2 1/20 0.49
CYP1A2 P05177 1/20 0.49
CYP2D6 P10635 1/20 0.49
PDE4A P27815 1/20 0.49
SMN1; SMN2 Q16637 1/20 0.49
HIF1A Q16665 1/20 0.49
HDAC10 Q969S8 1/20 0.49
HDAC6 Q9UBN7 1/20 0.49
L3MBTL1 Q9Y468 2/20 0.46
LMNA P02545 1/20 0.46
GAA P10253 1/20 0.44

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
SCHEMBL2628204 1.00 ALDH1A1 (0.58) ALDH1A1POLBAPPTSPOKDM4E
SCHEMBL7153441 0.87 POLB (0.56) ALDH1A1POLBKDM4ECYP1A2CYP2D6
SCHEMBL10897821 0.86 POLB (0.54) POLBKDM4ECYP1A2CYP2D6PDE4A
SCHEMBL9826297 0.86 POLB (0.54) ALDH1A1POLBKDM4ECYP1A2CYP2D6
Ethylene SCHEMBL10898008 0.84 POLB (0.53) ALDH1A1POLBKDM4ECYP1A2CYP2D6
SCHEMBL9632476 0.84 LMNA (0.60) ALDH1A1POLBKDM4ECYP1A2CYP2D6
SCHEMBL2628195 0.84 PLA2G4B (0.55) ALDH1A1APPL3MBTL1LMNA
SCHEMBL8347541 0.84 KDM4E (0.68) ALDH1A1POLBKDM4ECYP1A2CYP2D6
SCHEMBL2628191 0.84 PLA2G4B (0.55) ALDH1A1APPL3MBTL1LMNA
SCHEMBL9826466 0.83 GAA (0.54) ALDH1A1POLBKDM4ECYP1A2CYP2D6

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-20120100073-A1 PET RADIOTRACERS FOR IMAGING FATTY ACID METABOLISM AND STORAGE WASHINGTON UNIVERSITY (US) 2012-04-26 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-20120100073-A1 PET RADIOTRACERS FOR IMAGING FATTY ACID METABOLISM AND STORAGE LIPC, PNLIP, FFAR1 ALDH1A1 838/4885POLB 3372/4885APP 1821/4885

“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.