SCHEMBL1483638

SCHEMBL1483638

COc1cc2ncnc(Nc3ccc(N)c(F)c3)c2cc1OC

nearest known ligand 0.71

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 17/20 0.71
KDR P35968 8/20 0.71
RET P07949 5/20 0.71
CLK1 P49759 2/20 0.71
FBP1 P09467 2/20 0.71
KIF5B P33176 2/20 0.71
RIPK2 O43353 2/20 0.71
AURKA O14965 1/20 0.71
ERBB2 P04626 1/20 0.71
INSR P06213 1/20 0.71
PDGFRB P09619 1/20 0.71
FLT4 P35916 1/20 0.71
EPHB4 P54760 1/20 0.71
TEK Q02763 1/20 0.71
AURKB Q96GD4 1/20 0.71
NOD1 Q9Y239 1/20 0.71
ABCG2 Q9UNQ0 1/20 0.70
LCK P06239 5/20 0.69
FLT1 P17948 1/20 0.64
GAK O14976 1/20 0.64

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
SCHEMBL6792594 0.90 EGFR (0.74) EGFRKDRRETCLK1FBP1
SCHEMBL20812874 0.85 EGFR (0.80) EGFRKDRRETCLK1FBP1
SCHEMBL5864719 0.85 KDR (0.82) EGFRKDRRETCLK1FBP1
SCHEMBL3533221 0.84 EGFR (0.80) EGFRKDRRETCLK1KIF5B
SCHEMBL6783334 0.84 KDR (0.74) EGFRKDRRETCLK1KIF5B
Hydrochloric Acid SCHEMBL8871198 0.83 EGFR (0.80) EGFRKDRRETCLK1KIF5B
SCHEMBL5478005 0.83 EGFR (1.00) EGFRKDRRETCLK1FBP1
SCHEMBL5565137 0.83 EGFR (1.00) EGFRKDRRETCLK1KIF5B
SCHEMBL2099106 0.83 EGFR (1.00) EGFRKDRCLK1FBP1AURKA
SCHEMBL6787016 0.83 KDR (0.74) EGFRKDRRETCLK1FBP1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-11124482-B2 C-met modulators and methods of use EXELIXIS, INC. (US) 2021-09-21 US disclosed
US-20210253530-A9 C-MET MODULATORS AND METHODS OF USE EXELIXIS, INC. 2021-08-19 US disclosed
US-20170355678-A1 C-Met Modulators and Methods of Use EXELIXIS INC (US) 2017-12-14 US disclosed
US-20110077233-A1 C-Met Modulators and Method of Use EXELIXIS, INC. (US) 2011-03-31 US disclosed
US-7579473-B2 N-(4-{[7-{[3-(diethylamino)propyl] oxy}-6-(methyloxy) quinazolin-4-yl]oxy}-3- fluorophenyl)-N'-(4- fluorophenyl) cyclopropane-1,1-dicarboxamide; for modulating protein kinase enzymatic activity for modulating cell activities such as proliferation, differentiation, programmed cell death EXELIXIS, INC. (US) 2009-08-25 US disclosed
US-20090170896-A1 c-Met modulators and methods of use EXELIXIS, INC. (US) 2009-07-02 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 (5 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-20170355678-A1 C-Met Modulators and Methods of Use FLT4, FLT1, MET EGFR 124/4885KDR 4/4885RET 8/4885
US-20210253530-A9 C-MET MODULATORS AND METHODS OF USE FLT4, FLT1, MET EGFR 124/4885KDR 4/4885RET 8/4885
US-20090170896-A1 c-Met modulators and methods of use FLT4, MET, FLT1 EGFR 166/4885KDR 5/4885RET 27/4885
US-11124482-B2 C-met modulators and methods of use FLT4, FLT1, MET EGFR 124/4885KDR 4/4885RET 8/4885
US-20110077233-A1 C-Met Modulators and Method of Use FLT4, MET, FLT1 EGFR 181/4885KDR 5/4885RET 35/4885

“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.