SCHEMBL21919490

SCHEMBL21919490

CC1(C)Cc2cc(N)c(O[C@H]3CN(CC(N)=O)C[C@@H]3NC(=O)OCc3ccccc3)cc2O1

nearest known ligand 0.38

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
▸ IRAK4 Q9NWZ3 8/20 0.38
▸ TACR1 P25103 2/20 0.36
▸ CPB1 P15086 1/20 0.36
▸ TSHR P16473 1/20 0.35
▸ CA1 P00915 1/20 0.34
▸ CA2 P00918 1/20 0.34
▸ ACHE P22303 1/20 0.34
▸ CTSL P07711 1/20 0.33
▸ CTSB P07858 1/20 0.33
▸ CTSK P43235 1/20 0.33

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
SCHEMBL28889962 1.00 IRAK4 (0.38) IRAK4TACR1CPB1TSHRCA1
SCHEMBL28404099 1.00 IRAK4 (0.38) IRAK4TACR1CPB1TSHRCA1
SCHEMBL28407821 0.89 IRAK4 (0.36) IRAK4TACR1CPB1TSHRCA1
SCHEMBL28407817 0.89 IRAK4 (0.36) IRAK4TACR1CPB1TSHRCA1
SCHEMBL21852507 0.87 IRAK4 (0.41) IRAK4
SCHEMBL21919703 0.81 IRAK4 (0.67) IRAK4
SCHEMBL20594507 0.75 IRAK4 (0.39) IRAK4
SCHEMBL21852669 0.73 PDE4B (0.42) —
SCHEMBL21852671 0.73 PDE4B (0.42) —
SCHEMBL19030548 0.72 IRAK4 (0.58) 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 2 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11034698-B2 Pyrazolo[ 1,5a]pyrimidine derivatives as IRAK4 modulators GENENTECH, INC. (US) 2021-06-15 — — US disclosed
US-20200123166-A1 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS GENENTECH, INC. (US) 2020-04-23 — — 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 (2 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-11034698-B2 Pyrazolo[ 1,5a]pyrimidine derivatives as IRAK4 modulators IRAK4, IRAK1, IRAK2 IRAK4 1/4885TACR1 4713/4885CPB1 3104/4885
US-20200123166-A1 PYRAZOLO[1,5a]PYRIMIDINE DERIVATIVES AS IRAK4 MODULATORS IRAK4, IRAK1, IRAK2 IRAK4 1/4885TACR1 4713/4885CPB1 3104/4885

“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.

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