SCHEMBL4462956

SCHEMBL4462956

COc1cc2ncnc(Nc3ccc(Oc4cccc(F)c4)c(OC)c3)c2cc1OC

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 15/20 0.76
LCK P06239 4/20 0.74
CLK1 P49759 2/20 0.69
ABCG2 Q9UNQ0 1/20 0.69
KDR P35968 6/20 0.67
RET P07949 4/20 0.67
SRC P12931 1/20 0.67
GAK O14976 1/20 0.65
RIPK2 O43353 2/20 0.64
EPHB2 P29323 1/20 0.64
ERBB4 Q15303 1/20 0.61
KIF5B P33176 2/20 0.60
FBP1 P09467 2/20 0.60
AURKA O14965 1/20 0.60
ERBB2 P04626 1/20 0.60
INSR P06213 1/20 0.60
PDGFRB P09619 1/20 0.60
FLT4 P35916 1/20 0.60
EPHB4 P54760 1/20 0.60
TEK Q02763 1/20 0.60

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
SCHEMBL4471854 0.92 KDR (0.69) EGFRLCKCLK1ABCG2KDR
SCHEMBL18158231 0.91 EGFR (0.83) EGFRLCKABCG2KDRRET
SCHEMBL4461985 0.89 EGFR (0.60) EGFRLCKCLK1ABCG2KDR
SCHEMBL4472397 0.87 EGFR (0.58) EGFRLCKCLK1ABCG2KDR
SCHEMBL4458762 0.86 EGFR (0.57) EGFRLCKCLK1ABCG2KDR
SCHEMBL5482884 0.86 EGFR (1.00) EGFRLCKABCG2KDRRET
Hydrochloric Acid SCHEMBL5475745 0.85 EGFR (1.00) EGFRLCKABCG2KDRRET
SCHEMBL4458635 0.84 SRC (0.76) EGFRLCKABCG2KDRRET
SCHEMBL4473865 0.84 KDR (0.55) EGFRLCKCLK1ABCG2KDR
SCHEMBL18158268 0.84 EGFR (0.76) EGFRLCKCLK1ABCG2KDR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040242604-A1 Substituted heterocycles for the treatment of abnormal cell growth PFIZER INC 2004-12-02 US claimed
US-7585869-B2 Substituted heterocylces for the treatment of abnormal cell growth PFIZER, INC. (US) 2009-09-08 US disclosed
EP-1636195-A1 QUINAZOLINES AND PYRIDO[3,4-D]PYRIMIDINES AS RECEPTOR TYROSINE KINASE INHIBITORS Pfizer Products Inc. (US) 2006-03-22 EP disclosed
WO-2004106308-A1 QUINAZOLINES AND PYRIDO [3,4-D] PYRIMIDINES AS RECEPTOR TYROSINE KINASE INHIBITORS PFIZER PRODUCTS INC. (US) 2004-12-09 WO disclosed
US-20040242604-A1 Substituted heterocycles for the treatment of abnormal cell growth PFIZER INC 2004-12-02 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-20040242604-A1 Substituted heterocycles for the treatment of abnormal cell growth CCNA1, CCNT1, CCNY EGFR 166/4885LCK 3238/4885CLK1 4139/4885

“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.