SCHEMBL3812958

SCHEMBL3812958

CN(C)CCOc1cccc2ncnc(Nc3ccc(O)c(F)c3)c12

nearest known ligand 0.50

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
EGFR P00533 10/20 0.50
ERBB2 P04626 10/20 0.49
RET P07949 3/20 0.49
DYRK1A Q13627 1/20 0.48
DYRK1B Q9Y463 1/20 0.48
KIF5B P33176 2/20 0.44
RIPK2 O43353 1/20 0.42
KDR P35968 1/20 0.42
NOD1 Q9Y239 1/20 0.42
KCNH2 Q12809 2/20 0.42

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
SCHEMBL3812508 0.89 ERBB2 (0.50) EGFRERBB2RETKIF5BKDR
SCHEMBL3808108 0.88 EGFR (0.53) EGFRERBB2RETKIF5BKDR
SCHEMBL3810503 0.88 ERBB2 (0.57) EGFRERBB2KCNH2
SCHEMBL3817555 0.82 KDR (0.49) EGFRERBB2RETDYRK1ADYRK1B
SCHEMBL3808303 0.80 ERBB2 (0.45) EGFRERBB2KDRKCNH2
SCHEMBL3810411 0.79 DYRK1A (0.54) EGFRRETDYRK1ADYRK1BKIF5B
SCHEMBL4480933 0.79 ERBB2 (0.55) EGFRERBB2KDRKCNH2
SCHEMBL4480016 0.78 EGFR (0.48) EGFRERBB2RETKIF5BKDR
SCHEMBL4485031 0.78 ERBB2 (0.62) EGFRERBB2KCNH2
SCHEMBL3811494 0.78 EGFR (0.52) EGFRERBB2

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-1631292-B1 4-ANILINO-QUINAZOLINE DERIVATIVES AS ANTIPROLIFERATIVE AGENTS ASTRAZENECA AB (SE) 2009-08-05 EP disclosed
US-20070149546-A1 4-Anilino-quinazoline derivatives as antiproliferative agents ASTRAZENECA AB (SE) 2007-06-28 US disclosed
EP-1631292-A1 4-ANILINO-QUINAZOLINE DERIVATIVES AS ANTIPROLIFERATIVE AGENTS Astra Zeneca AB (SE) 2006-03-08 EP disclosed
WO-2004093880-A1 4-ANILINO-QUINAZOLINE DERIVATIVES AS ANTIPROLIFERATIVE AGENTS ASTRAZENECA AB (SE) 2004-11-04 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-20070149546-A1 4-Anilino-quinazoline derivatives as antiproliferative agents ABL1, ERBB2, ERBB4 EGFR 10/4885ERBB2 2/4885RET 191/4885

“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.