SCHEMBL6989639

SCHEMBL6989639

Fc1ccc(Nc2ncnc3cc(OCCBr)c(OC[C@@H]4CCCO4)cc23)cc1Cl

nearest known ligand 0.70

Predicted protein targets (top 7)

geneUniProtsupporting neighboursconfidence
EPHA2 P29317 5/20 0.70
KDR P35968 3/20 0.70
EGFR P00533 13/20 0.68
EPHB4 P54760 2/20 0.63
FBP1 P09467 1/20 0.58
RET P07949 1/20 0.56
KIF5B P33176 1/20 0.56

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
SCHEMBL7219862 1.00 EPHA2 (0.70) EPHA2KDREGFREPHB4FBP1
SCHEMBL7221058 1.00 EPHA2 (0.70) EPHA2KDREGFREPHB4FBP1
SCHEMBL7221051 1.00 EPHA2 (0.70) EPHA2KDREGFREPHB4FBP1
SCHEMBL4359307 0.90 EPHA2 (0.85) EPHA2KDREGFREPHB4FBP1
SCHEMBL6991150 0.88 EPHA2 (0.69) EPHA2KDREGFREPHB4FBP1
SCHEMBL7218842 0.88 EPHA2 (0.69) EPHA2KDREGFREPHB4FBP1
SCHEMBL1191334 0.87 EGFR (0.70) EPHA2KDREGFREPHB4FBP1
SCHEMBL7226666 0.87 KDR (0.68) EPHA2KDREGFREPHB4FBP1
SCHEMBL7221348 0.87 EGFR (0.70) EPHA2KDREGFREPHB4FBP1
SCHEMBL6998297 0.87 EGFR (0.70) EPHA2KDREGFREPHB4FBP1

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
US-6656946-B2 For treating diseases, particularly tumoral diseases, diseases of the lungs and respiratory tract BOEHRINGER INGELHEIM PHARMA KG (DE) 2003-12-02 US disclosed
EP-1315705-A1 BICYCLIC HETEROCYCLES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE, AND METHODS FOR THE PRODUCTION THEREOF BOEHRINGER INGELHEIM ZENTRALE GMBH (DE) 2003-06-04 EP disclosed
US-20020082271-A1 Aminoquinazolines which inhibit signal transduction mediated by tyrosine kinases BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-06-27 US disclosed
WO-2002018351-A1 BICYCLIC HETEROCYCLES, MEDICAMENTS CONTAINING THESE COMPOUNDS, THEIR USE, AND METHODS FOR THE PRODUCTION THEREOF BOEHRINGER INGELHEIM PHARMA GMBH & CO. KG (DE) 2002-03-07 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-20020082271-A1 Aminoquinazolines which inhibit signal transduction mediated by tyrosine kinases MAP3K1, MAP3K19, MAP3K20 EPHA2 1142/4885KDR 500/4885EGFR 137/4885

“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.