SCHEMBL21846862

SCHEMBL21846862

C=CC(=O)Nc1cccc(Cn2ncc3cnc(Nc4ccc(N5CCN(C)CC5)cc4)nc32)c1

nearest known ligand 0.78

Predicted protein targets (top 9)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 15/20 0.78
▸ EGFR P00533 6/20 0.76
▸ BTK Q06187 4/20 0.76
▸ JAK2 O60674 3/20 0.76
▸ JAK1 P23458 1/20 0.76
▸ TYK2 P29597 1/20 0.76
▸ FLT3 P36888 2/20 0.65
▸ BLK P51451 2/20 0.59
▸ BMX P51813 1/20 0.59

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
SCHEMBL29388091 1.00 JAK3 (0.78) JAK3EGFRBTKJAK2JAK1
SCHEMBL29387594 0.92 JAK3 (0.65) JAK3EGFRBTKJAK2JAK1
SCHEMBL21846882 0.92 JAK3 (0.65) JAK3EGFRBTKJAK2JAK1
SCHEMBL21846825 0.91 JAK3 (0.68) JAK3EGFRBTKJAK2JAK1
SCHEMBL29388306 0.91 JAK3 (0.68) JAK3EGFRBTKJAK2JAK1
SCHEMBL21846880 0.91 JAK3 (0.64) JAK3EGFRBTKJAK2JAK1
SCHEMBL29387506 0.91 JAK3 (0.64) JAK3EGFRBTKJAK2JAK1
SCHEMBL17209892 0.88 JAK3 (1.00) JAK3EGFRBTKJAK2JAK1
SCHEMBL21846822 0.87 JAK3 (0.72) JAK3EGFRBTKJAK2JAK1
SCHEMBL18001919 0.85 JAK3 (0.73) JAK3EGFRBTKJAK2JAK1

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-20220048914-A1 PREPARATION FOR 6-AMINO-1H-PYRAZOLO[3,4-D]PYRIMIDINE-BASED JAK KINASE INHIBITOR AND APPLICATION THEREOF CHINA PHARMACEUTICAL UNIVERSITY (CN) 2022-02-17 — — US disclosed
WO-2020052489-A1 PREPARATION FOR 6-AMINO-1H-PYRAZOLO[3,4-D]PYRIMIDINE-BASED JAK KINASE INHIBITOR AND APPLICATION THEREOF 中国药科大学 2020-03-19 — — WO 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-20220048914-A1 PREPARATION FOR 6-AMINO-1H-PYRAZOLO[3,4-D]PYRIMIDINE-BASED JAK KINASE INHIBITOR AND APPLICATION THEREOF JAK1, JAK3, SSB JAK3 2/4885EGFR 2648/4885BTK 8/4885

“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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