SCHEMBL19124184

SCHEMBL19124184

O=C(/C=C/CBr)Nc1cc2c(Nc3ccc(F)c(Cl)c3)ncnc2cc1OCCOC(F)F

nearest known ligand 0.73

Predicted protein targets (top 4)

geneUniProtsupporting neighboursconfidence
▸ EGFR P00533 20/20 0.73
▸ ERBB2 P04626 12/20 0.73
▸ ERBB4 Q15303 3/20 0.65
▸ JAK3 P52333 1/20 0.64

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
SCHEMBL16405547 0.91 EGFR (0.83) EGFRERBB2ERBB4JAK3
SCHEMBL17498519 0.91 EGFR (0.83) EGFRERBB2ERBB4JAK3
SCHEMBL19100056 0.90 EGFR (0.89) EGFRERBB2ERBB4JAK3
SCHEMBL21761366 0.89 EGFR (0.84) EGFRERBB2ERBB4JAK3
SCHEMBL19100271 0.89 EGFR (0.71) EGFRERBB2ERBB4JAK3
SCHEMBL16398696 0.88 EGFR (0.79) EGFRERBB2ERBB4JAK3
SCHEMBL16398699 0.88 EGFR (0.79) EGFRERBB2ERBB4JAK3
SCHEMBL19100301 0.88 EGFR (0.85) EGFRERBB2ERBB4JAK3
SCHEMBL19125881 0.88 EGFR (0.58) EGFRERBB2
SCHEMBL19100300 0.88 EGFR (0.73) EGFRERBB2ERBB4JAK3

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-20190016689-A1 NOVEL FLUORINATED QUINAZOLINE DERIVATIVES AS EGFR INHIBITORS TRILLIUM THERAPEUTICS INC. (CA) 2019-01-17 — — US disclosed
US-20190016689-A1 NOVEL FLUORINATED QUINAZOLINE DERIVATIVES AS EGFR INHIBITORS TRILLIUM THERAPEUTICS INC. (CA) 2019-01-17 — — US disclosed
WO-2017117680-A1 NOVEL FLUORINATED QUINAZOLINE DERIVATIVES AS EGFR INHIBITORS TRILLIUM THERAPEUTICS INC. (CA) 2017-07-13 — — 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-20190016689-A1 NOVEL FLUORINATED QUINAZOLINE DERIVATIVES AS EGFR INHIBITORS EGFR, ERBB2, ERBB4 EGFR 1/4885ERBB2 2/4885ERBB4 3/4885

“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.

Send feedback