SCHEMBL6466048

SCHEMBL6466048

COc1cc2c(Nc3ccc(Br)cc3F)ncnc2cc1OCC1CCCCN1C

nearest known ligand 0.76

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.76
EGFR P00533 14/20 0.76
FGFR1 P11362 12/20 0.76
FLT1 P17948 12/20 0.76
FLT4 P35916 12/20 0.76
EPHA2 P29317 5/20 0.76
PDGFRB P09619 3/20 0.76
EPHB4 P54760 3/20 0.76
RET P07949 3/20 0.76
TEK Q02763 2/20 0.76
KIF5B P33176 2/20 0.76
FGFR2 P21802 2/20 0.76
FGFR4 P22455 2/20 0.76
FGFR3 P22607 2/20 0.76
ERBB2 P04626 2/20 0.76
BMPR1B O00238 1/20 0.76
PLK4 O00444 1/20 0.76
CIT O14578 1/20 0.76
GAK O14976 1/20 0.76
EPHB6 O15197 1/20 0.76

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
Hydrochloric Acid SCHEMBL5420526 0.90 FGFR1 (0.77) KDREGFRFGFR1FLT1FLT4
SCHEMBL27218180 0.86 EGFR (1.00) KDREGFRFGFR1FLT1FLT4
Vandetanib SCHEMBL28224661 0.86 EGFR (1.00) KDREGFRFGFR1FLT1FLT4
Vandetanib SCHEMBL29352879 0.86 EGFR (1.00) KDREGFRFGFR1FLT1FLT4
Vandetanib SCHEMBL9044 0.86 EGFR (1.00) KDREGFRFGFR1FLT1FLT4
Vandetanib SCHEMBL4637084 0.85 EGFR (0.98) KDREGFRFGFR1FLT1FLT4
Vandetanib SCHEMBL1614458 0.85 EGFR (1.00) KDREGFRFGFR1FLT1FLT4
SCHEMBL17520347 0.84 KDR (0.82) KDREGFRFGFR1FLT1FLT4
SCHEMBL5447733 0.84 EPHA2 (0.78) KDREGFRFGFR1FLT1FLT4
SCHEMBL26359052 0.84 EGFR (0.85) KDREGFRFGFR1FLT1FLT4

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-20050043395-A1 Combination therapy comprising zd6474 and a taxane ASTRAZENECA AB (SE) 2005-02-24 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-20050043395-A1 Combination therapy comprising zd6474 and a taxane ZYX, VEGFA, TEK KDR 4/4885EGFR 192/4885FGFR1 1638/4885

“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.