SCHEMBL23014741

SCHEMBL23014741

CCCSCCCCCCCCCCCCCC#CC(F)(F)F

nearest known ligand 0.36

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
CES1 P23141 5/20 0.36
FAAH O00519 4/20 0.36
CES2 O00748 2/20 0.36
PLA2G6 O60733 1/20 0.36
LMNA P02545 1/20 0.31

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
SCHEMBL23014864 0.87 FAAH (0.33) CES1FAAHCES2PLA2G6LMNA
SCHEMBL23014898 0.83 LMNA (0.36) CES1FAAHCES2PLA2G6LMNA
SCHEMBL1014316 0.81
SCHEMBL2043689 0.80 PTPN7 (0.42) CES1FAAHCES2LMNA
SCHEMBL9548439 0.80 PTPN7 (0.42) CES1FAAHCES2LMNA
SCHEMBL1017045 0.79
SCHEMBL1015598 0.79
SCHEMBL1015892 0.79 TRPA1 (0.35) LMNA
SCHEMBL8024226 0.78 LMNA (0.39) CES1FAAHCES2LMNA
SCHEMBL1015808 0.77

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-20220298185-A1 Nucleoside Prodrugs and Uses Related Thereto UNIV EMORY (US) 2022-09-22 US claimed
EP-4017499-A1 NUCLEOSIDE PRODRUGS AND USES RELATED THERETO Emory University (US) 2022-06-29 EP claimed
WO-2021035214-A1 NUCLEOSIDE PRODRUGS AND USES RELATED THERETO EMORY UNIVERSITY (US) 2021-02-25 WO claimed

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-20220298185-A1 Nucleoside Prodrugs and Uses Related Thereto PNPO, GSTO1, CYP2C18 CES1 33/4885FAAH 445/4885CES2 318/4885

“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.