SCHEMBL29537347

SCHEMBL29537347

CN1CCN(c2cnc(Cl)nc2Oc2cccc(NC(=O)OC(C)(C)C)c2)CC1

nearest known ligand 0.48

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 15/20 0.48
JAK2 O60674 3/20 0.48
JAK3 P52333 3/20 0.48
BLK P51451 2/20 0.48
BMX P51813 2/20 0.48
CTSC P53634 4/20 0.46
NUAK1 O60285 2/20 0.45
NUAK2 Q9H093 2/20 0.45
BTK Q06187 3/20 0.44
PLK4 O00444 1/20 0.44
GAK O14976 1/20 0.44
FLT3 P36888 1/20 0.44
PTK2 Q05397 1/20 0.44
ITK Q08881 1/20 0.44
ERBB4 Q15303 1/20 0.44
DCLK3 Q9C098 1/20 0.44
EML4 Q9HC35 1/20 0.44
EIF2AK4 Q9P2K8 1/20 0.44
ALK Q9UM73 1/20 0.44
NPC1 O15118 1/20 0.43

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
SCHEMBL24392962 1.00 EGFR (0.48) EGFRJAK2JAK3BLKBMX
SCHEMBL24392961 0.84 EGFR (0.51) EGFRJAK2JAK3BLKBMX
SCHEMBL29537062 0.84 EGFR (0.51) EGFRJAK2JAK3BLKBMX
SCHEMBL4171563 0.83 EGFR (0.48) EGFRJAK2JAK3BLKBMX
SCHEMBL9945483 0.83 EGFR (0.43) EGFRITK
SCHEMBL13166463 0.82 SYK (0.51) EGFRBTKITK
SCHEMBL4175660 0.82 EGFR (0.45) EGFRBTKFLT3
SCHEMBL29537718 0.82 EGFR (0.45) EGFRBTKFLT3
SCHEMBL4166321 0.80 EGFR (0.49) EGFRBTKKDR
SCHEMBL29250596 0.79 PIN1 (0.41) EGFRJAK2JAK3BLKBMX

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 3 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20240051945-A1 PYRIMIDINE COMPOUNDS, COMPOSITIONS, AND MEDICINAL APPLICATIONS THEREOF BLUEPRINT MEDICINES CORPORATION 2024-02-15 US disclosed
EP-4237418-A1 PYRIMIDINE COMPOUNDS, COMPOSITIONS, AND MEDICINAL APPLICATIONS THEREOF Blueprint Medicines Corporation (US) 2023-09-06 EP disclosed
WO-2022094354-A1 PYRIMIDINE COMPOUNDS, COMPOSITIONS, AND MEDICINAL APPLICATIONS THEREOF LENGO THERAPEUTICS, INC. (US) 2022-05-05 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-20240051945-A1 PYRIMIDINE COMPOUNDS, COMPOSITIONS, AND MEDICINAL APPLICATIONS THEREOF TYMP, DPYD, TYMS EGFR 4504/4885JAK2 1372/4885JAK3 1266/4885

“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.