SCHEMBL3673758

SCHEMBL3673758

COc1cc2c(Nc3cccc4c(Cl)c[nH]c34)ncnc2cc1OCC(O)CN1CCN(CC#N)CC1

nearest known ligand 0.62

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
SRC P12931 5/20 0.62
KDR P35968 5/20 0.62
EGFR P00533 7/20 0.55
AURKA O14965 1/20 0.47
KCNH2 Q12809 2/20 0.45
RET P07949 3/20 0.44
KIF5B P33176 1/20 0.44
EPHA2 P29317 1/20 0.44
ERBB2 P04626 1/20 0.43
CYP2D6 P10635 1/20 0.43

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
SCHEMBL3673970 0.91 KDR (0.67) SRCKDREGFRAURKAKCNH2
SCHEMBL6881082 0.91 KDR (0.66) SRCKDREGFRAURKAKCNH2
SCHEMBL3671772 0.91 KDR (0.66) SRCKDREGFRAURKAKCNH2
SCHEMBL6881088 0.91 KDR (0.66) SRCKDREGFRAURKAKCNH2
SCHEMBL3676968 0.90 SRC (0.76) SRCKDREGFRKCNH2EPHA2
SCHEMBL3673251 0.89 KDR (0.58) SRCKDREGFRKCNH2RET
SCHEMBL3668458 0.86 KDR (0.62) SRCKDREGFRAURKAKCNH2
SCHEMBL3202365 0.82 SRC (0.60) SRCKDREGFRAURKARET
SCHEMBL3669402 0.82 SRC (0.60) SRCKDREGFRAURKARET
SCHEMBL6055729 0.81 KDR (0.60) SRCKDREGFRRETKIF5B

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20040063733-A1 Such as 4-(7-indolylamino)-6-methoxy-7-(3-morpholinopropoxy)-quinazoline; for treating solid tumors ASTRAZENECA AB (SE) 2004-04-01 US claimed
EP-1332141-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2003-08-06 EP claimed
WO-2002034744-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-05-02 WO claimed
EP-1562612-B1 COMBINATION PRODUCT OF INHIBITOR OF THE SRC FAMILY OF NON-RECEPTOR TYROSINE KINASES AND GEMCITABINE FOR USE IN THE TREATMENT OR PROPHLAXIX OF PANCREATIC CANCER ASTRAZENECA AB (SE) 2010-01-27 EP disclosed
US-20060142297-A1 Combination product of inhibitor of the src family of non-recetpor tyrosine kinases and gemcitabine ASTRAZENECA AB (SE) 2006-06-29 US disclosed
US-20040063733-A1 Such as 4-(7-indolylamino)-6-methoxy-7-(3-morpholinopropoxy)-quinazoline; for treating solid tumors ASTRAZENECA AB (SE) 2004-04-01 US disclosed
EP-1332141-A1 QUINAZOLINE DERIVATIVES AstraZeneca AB (SE) 2003-08-06 EP disclosed
WO-2002034744-A1 QUINAZOLINE DERIVATIVES ASTRAZENECA AB (SE) 2002-05-02 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 (2 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-20040063733-A1 Such as 4-(7-indolylamino)-6-methoxy-7-(3-morpholinopropoxy)-quinazoline; for treating solid tumors MIF, CCNI, MMP7 SRC 1355/4885KDR 1855/4885EGFR 862/4885
US-20060142297-A1 Combination product of inhibitor of the src family of non-recetpor tyrosine kinases and gemcitabine SRC, PTPN4, PTPN1 SRC 1/4885KDR 825/4885EGFR 155/4885

“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.