SCHEMBL23277751

SCHEMBL23277751

CC(C)(C)OC[C@H]1CCC(=O)N1

nearest known ligand 0.40

Predicted protein targets (top 5)

geneUniProtsupporting neighboursconfidence
IRAK4 Q9NWZ3 14/20 0.40
PDK2 Q15119 3/20 0.36
ALDH1A1 P00352 1/20 0.35
LMNA P02545 1/20 0.34
IRAK1 P51617 1/20 0.34

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
SCHEMBL21122216 1.00 IRAK4 (0.40) IRAK4PDK2ALDH1A1LMNAIRAK1
SCHEMBL5992949 0.89 IRAK4 (0.37) IRAK4PDK2ALDH1A1LMNA
SCHEMBL24335316 0.82 IRAK4 (0.34) IRAK4PDK2LMNA
SCHEMBL9865753 0.79
SCHEMBL12459955 0.79
SCHEMBL12409742 0.79
SCHEMBL2453167 0.77 IRAK4 (0.38) IRAK4PDK2IRAK1
Hydrochloric Acid SCHEMBL27036387 0.77 IRAK4 (0.39) IRAK4PDK2IRAK1
Hydrochloric Acid SCHEMBL30683992 0.77 IRAK4 (0.39) IRAK4PDK2IRAK1
SCHEMBL1715768 0.76

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-10988478-B1 Pyrazolo[1,5a]pyrimidine derivatives as IRAK4 modulators GENENTECH, INC. (US) 2021-04-27 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-10988478-B1 Pyrazolo[1,5a]pyrimidine derivatives as IRAK4 modulators IRAK1, IRAK4, IRAK2 IRAK4 2/4885PDK2 612/4885ALDH1A1 1146/4885

“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.