SCHEMBL25827940

SCHEMBL25827940

CC(=O)COCCCC(C)(C)C

nearest known ligand 0.55

Predicted protein targets (top 3)

geneUniProtsupporting neighboursconfidence
CES2 O00748 2/20 0.55
HRH3 Q9Y5N1 2/20 0.34
GAA P10253 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
SCHEMBL26749036 0.96 CES2 (0.57) CES2HRH3
SCHEMBL14882779 0.94 CES2 (0.59) CES2HRH3GAA
SCHEMBL26749030 0.92 CES2 (0.57) CES2HRH3
SCHEMBL26749058 0.92 CES2 (0.62) CES2HRH3
SCHEMBL26749033 0.90 CES2 (0.55) CES2HRH3
SCHEMBL26749019 0.88 CES2 (0.58) CES2HRH3
SCHEMBL26749082 0.88 CES2 (0.57) CES2HRH3
SCHEMBL26749079 0.88 CES2 (0.52) CES2HRH3
SCHEMBL26749077 0.86 CES2 (0.48) CES2GAA
SCHEMBL26749062 0.83 CES2 (0.45) CES2HRH3GAA

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-11701427-B2 Diels-alder conjugation methods REGENERON PHARMACEUTICALS, INC. (US) 2023-07-18 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-11701427-B2 Diels-alder conjugation methods GLUL, TGM2, GLS CES2 1693/4885HRH3 2453/4885GAA 48/4885

“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.