SCHEMBL26463501

SCHEMBL26463501

CCCCCCCCCCCC(=O)C(=O)/C=C/C(C)=O

nearest known ligand 0.58

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.58
CES2 O00748 4/20 0.58
FAAH O00519 2/20 0.46
GPR84 Q9NQS5 7/20 0.45
PPARG P37231 6/20 0.45
PPARD Q03181 6/20 0.45
PPARA Q07869 6/20 0.45
HDAC11 Q96DB2 5/20 0.45
TSHR P16473 4/20 0.45
ALDH1A1 P00352 2/20 0.45
TLR2 O60603 2/20 0.45
TDP1 Q9NUW8 2/20 0.45
FABP4 P15090 2/20 0.45
PTPN1 P18031 2/20 0.45
SLC22A6 Q4U2R8 1/20 0.45
SLC22A8 Q8TCC7 1/20 0.45
MEN1 O00255 1/20 0.45
ESR1 P03372 1/20 0.45
ALOX15 P16050 1/20 0.45
PDE4A P27815 1/20 0.45

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
SCHEMBL547458 0.84 CES2 (0.58) CES1CES2GPR84PPARGPPARD
Podoscyphic Acid SCHEMBL2437877 0.84 CES2 (0.58) CES1CES2GPR84PPARGPPARD
SCHEMBL2437216 0.84 CES2 (0.58) CES1CES2GPR84PPARGPPARD
SCHEMBL547457 0.84 CES2 (0.58) CES1CES2GPR84PPARGPPARD
SCHEMBL9822754 0.82 CES2 (0.60) CES1CES2FAAHGPR84PPARG
SCHEMBL26464087 0.79 CES2 (0.52) CES1CES2FAAHGPR84PPARG
SCHEMBL6060342 0.79 POLB (0.61) CES1CES2GPR84PPARGPPARD
SCHEMBL28053256 0.78 FAAH (0.62) FAAHPPARGPPARAFABP4ALOX15
SCHEMBL7952574 0.77 CES2 (0.54) CES1CES2GPR84PPARGPPARD
SCHEMBL17114371 0.77 CES2 (0.65) CES1CES2FAAHGPR84PPARG

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-20230139593-A1 TREATMENT OF DISORDERS ASSOCIATED WITH OXIDATIVE STRESS AND COMPOUNDS FOR SAME BOARD OF REGENTS, THE UNIVERSITY OF TEXAS SYSTEM 2023-05-04 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-20230139593-A1 TREATMENT OF DISORDERS ASSOCIATED WITH OXIDATIVE STRESS AND COMPOUNDS FOR SAME GPX4, TXNRD2, TXN2 CES1 1577/4885CES2 397/4885FAAH 432/4885

“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.