SCHEMBL29935006

SCHEMBL29935006

CC1(C)Cc2cc(NC(=O)c3cnn4cccnc34)c(OCc3cccnc3)cc2O1

nearest known ligand 1.00 ✓ in ChEMBL — recovers established targets

Predicted protein targets (top 1)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 20/20 1.00

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
SCHEMBL19045866 1.00 IRAK4 (1.00) IRAK4
SCHEMBL29935145 0.92 IRAK4 (1.00) IRAK4
SCHEMBL19045864 0.92 IRAK4 (1.00) IRAK4
SCHEMBL29935198 0.89 IRAK4 (1.00) IRAK4
SCHEMBL19045863 0.89 IRAK4 (1.00) IRAK4
SCHEMBL19030440 0.87 IRAK4 (1.00) IRAK4
SCHEMBL19030230 0.85 IRAK4 (1.00) IRAK4
SCHEMBL19045867 0.85 IRAK4 (1.00) IRAK4
SCHEMBL29935225 0.85 IRAK4 (1.00) IRAK4
SCHEMBL19045862 0.84 IRAK4 (1.00) IRAK4

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-20220332718-A1 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS GENENTECH, INC. (US) 2022-10-20 — — 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-20220332718-A1 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS IRAK1, IRAK4, IRAK2 IRAK4 2/4885

“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.

Send feedback