SCHEMBL21846880

SCHEMBL21846880

C=CC(=O)Nc1ccc(Cn2ncc3cnc(Nc4ccc(N5CCN(C)CC5)cc4)nc32)cc1

nearest known ligand 0.64

Predicted protein targets (top 17)

geneUniProtsupporting neighboursconfidence
▸ JAK3 P52333 8/20 0.64
▸ EGFR P00533 5/20 0.63
▸ FLT3 P36888 3/20 0.63
▸ BLK P51451 2/20 0.63
▸ BTK Q06187 4/20 0.62
▸ JAK2 O60674 2/20 0.62
▸ JAK1 P23458 1/20 0.62
▸ TYK2 P29597 1/20 0.62
▸ MAP3K7 O43318 5/20 0.61
▸ MAP2K1 Q02750 5/20 0.61
▸ FGFR1 P11362 3/20 0.61
▸ MAPK1 P28482 3/20 0.61
▸ SRC P12931 3/20 0.61
▸ FGFR2 P21802 1/20 0.58
▸ FGFR4 P22455 1/20 0.58
▸ FGFR3 P22607 1/20 0.58
▸ BMX P51813 1/20 0.55

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
SCHEMBL29387506 1.00 JAK3 (0.64) JAK3EGFRFLT3BLKBTK
SCHEMBL29388091 0.91 JAK3 (0.78) JAK3EGFRFLT3BLKBTK
SCHEMBL21846862 0.91 JAK3 (0.78) JAK3EGFRFLT3BLKBTK
SCHEMBL21846885 0.91 JAK3 (0.55) JAK3EGFRFLT3BLKBTK
SCHEMBL29387810 0.91 JAK3 (0.55) JAK3EGFRFLT3BLKBTK
SCHEMBL21846878 0.91 JAK3 (0.68) JAK3EGFRFLT3BLKBTK
SCHEMBL29387386 0.91 JAK3 (0.68) JAK3EGFRFLT3BLKBTK
SCHEMBL21847367 0.85 JAK3 (0.66) JAK3JAK2JAK1MAP3K7MAP2K1
SCHEMBL29385265 0.85 JAK3 (0.66) JAK3JAK2JAK1MAP3K7MAP2K1
SCHEMBL21846877 0.85 JAK3 (0.60) JAK3EGFRFLT3BLKBTK

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 2648/4885FLT3 364/4885

“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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