SCHEMBL29722587

SCHEMBL29722587

C=CC(=O)Nc1ccc(Cl)c(Nc2nc(Nc3cccc(OC)c3)ncc2C(F)(F)F)c1

nearest known ligand 0.89

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.89
BTK Q06187 6/20 0.80
MAPK3 P27361 2/20 0.67
ITK Q08881 1/20 0.62
ERBB2 P04626 1/20 0.61
ERBB3 P21860 1/20 0.61
ERBB4 Q15303 1/20 0.61
JAK2 O60674 1/20 0.61
JAK3 P52333 1/20 0.61
PTK2 Q05397 1/20 0.61

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
SCHEMBL12519461 0.94 EGFR (1.00) EGFRBTKMAPK3ITKERBB2
SCHEMBL29722500 0.90 EGFR (1.00) EGFRBTKMAPK3ITKERBB2
SCHEMBL12519518 0.90 EGFR (1.00) EGFRBTKMAPK3ITKERBB2
SCHEMBL12519451 0.89 EGFR (1.00) EGFRBTKMAPK3ITKERBB2
SCHEMBL29722381 0.89 EGFR (1.00) EGFRBTKMAPK3ITKERBB2
SCHEMBL21443504 0.89 EGFR (0.89) EGFRBTKMAPK3ITKPTK2
SCHEMBL13185131 0.87 EGFR (0.83) EGFRBTKMAPK3ITKERBB2
SCHEMBL12518491 0.86 EGFR (0.85) EGFRBTKMAPK3ITKERBB2
SCHEMBL12518480 0.83 EGFR (0.86) EGFRBTKMAPK3ITKERBB2
SCHEMBL12519783 0.82 EGFR (0.85) EGFRBTKITKERBB2ERBB3

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-11351168-B1 2,4-disubstituted pyrimidines useful as kinase inhibitors CELGENE CAR LLC (BM) 2022-06-07 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-11351168-B1 2,4-disubstituted pyrimidines useful as kinase inhibitors DCK, CDK2, DTYMK EGFR 460/4885BTK 261/4885MAPK3 200/4885

“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.