SCHEMBL2137462

SCHEMBL2137462

COc1cc2c(Nc3c(F)cc(Br)cc3F)ncnc2cc1OCc1ccccc1

nearest known ligand 0.64

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
EGFR P00533 14/20 0.64
KDR P35968 12/20 0.64
FLT1 P17948 5/20 0.64
FGFR1 P11362 3/20 0.64
FLT4 P35916 3/20 0.64
FGFR2 P21802 1/20 0.62
FGFR4 P22455 1/20 0.62
FGFR3 P22607 1/20 0.62
RET P07949 4/20 0.62
KIF5B P33176 3/20 0.62
ERBB2 P04626 1/20 0.58
EPHA2 P29317 1/20 0.58
EPHB4 P54760 1/20 0.58
KDM4E B2RXH2 1/20 0.56
LMNA P02545 1/20 0.56
HPGD P15428 1/20 0.56
HTT P42858 1/20 0.56
LCK P06239 2/20 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
SCHEMBL2139115 0.90 KDR (0.66) EGFRKDRFLT1FGFR1FLT4
SCHEMBL159652 0.89 KDR (0.80) EGFRKDRFLT1FGFR1FLT4
SCHEMBL7962820 0.88 KDR (0.73) EGFRKDRFLT1FGFR1FLT4
Hydrochloric Acid SCHEMBL1468204 0.88 KDR (0.78) EGFRKDRFLT1FGFR1FLT4
Hydrochloric Acid SCHEMBL7215101 0.87 KDR (0.72) EGFRKDRFLT1FGFR1FLT4
SCHEMBL30891782 0.82 EGFR (0.83) EGFRKDRFLT1FGFR1RET
SCHEMBL22367364 0.82 EGFR (0.81) EGFRKDRFLT1FGFR1RET
Hydrochloric Acid SCHEMBL1782686 0.82 KDR (0.68) EGFRKDRFLT1FGFR1FLT4
SCHEMBL8933781 0.81 EGFR (0.68) EGFRKDRFLT1FLT4RET
SCHEMBL4421590 0.80 TRPA1 (0.61) EGFRKDRFLT1FLT4RET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20210276972-A1 Quinazoline Derivatives as VEGF Inhibitors GENZYME CORPORATION (US) 2021-09-09 US disclosed
US-20200262811-A1 Quinazoline Derivatives as VEGF Inhibitors GENZYME CORPORATION (US) 2020-08-20 US disclosed
US-10457664-B2 Quinazoline derivatives as VEGF inhibitors GENZYME CORPORATION (US) 2019-10-29 US disclosed
US-20190002433-A1 Quinazoline Derivatives as VEGF Inhibitors GENZYME CORPORATION (US) 2019-01-03 US disclosed
US-20180099946-A1 Quinazoline Derivatives as VEGF Inhibitors GENZYME CORPORATION (US) 2018-04-12 US disclosed
US-20160130249-A1 Quinazoline Derivatives as VEGF Inhibitors ASTRAZENECA AB (SE) 2016-05-12 US disclosed
US-9040548-B2 Quinazoline derivatives as VEGF inhibitors ASTRAZENECA AB (SE) 2015-05-26 US disclosed
US-20140121228-A1 Quinazoline Derivatives as VEGF Inhibitors ASTRAZENECA AB (SE) 2014-05-01 US disclosed
US-8642608-B2 Quinazoline derivatives as VEGF inhibitors ASTRAZENECA AB (SE) 2014-02-04 US disclosed
US-20110065736-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ASTRAZENECA AB (SE) 2011-03-17 US disclosed
EP-1676845-B1 New quinazoline derivatives ASTRAZENECA AB (SE) 2008-06-11 EP disclosed
US-20070265286-A1 Quinazoline derivatives as VEGF inhibitors ASTRAZENECA AB 2007-11-15 US disclosed
US-7173038-B1 Quinazoline derivatives as VEGF inhibitors ASTRAZENECA AB (SE) 2007-02-06 US disclosed
EP-1676845-A1 New quinazoline derivatives AstraZeneca AB (SE) 2006-07-05 EP disclosed
EP-1244647-B1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ASTRAZENECA AB (SE) 2006-06-21 EP disclosed
EP-1244647-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS AstraZeneca AB (SE) 2002-10-02 EP disclosed
WO-2001032651-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ASTRAZENECA AB (SE) 2001-05-10 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 (9 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-20180099946-A1 Quinazoline Derivatives as VEGF Inhibitors FLT4, FLT1, KDR EGFR 199/4885KDR 3/4885FLT1 2/4885
US-20210276972-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR EGFR 207/4885KDR 3/4885FLT1 1/4885
US-20110065736-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS FLT1, FLT4, KDR EGFR 183/4885KDR 3/4885FLT1 1/4885
US-10457664-B2 Quinazoline derivatives as VEGF inhibitors FLT1, FLT4, KDR EGFR 179/4885KDR 3/4885FLT1 1/4885
US-20070265286-A1 Quinazoline derivatives as VEGF inhibitors FLT1, FLT4, KDR EGFR 183/4885KDR 3/4885FLT1 1/4885
US-20160130249-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR EGFR 181/4885KDR 3/4885FLT1 1/4885
US-20140121228-A1 Quinazoline Derivatives as VEGF Inhibitors FLT4, FLT1, KDR EGFR 120/4885KDR 3/4885FLT1 2/4885
US-20200262811-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR EGFR 181/4885KDR 3/4885FLT1 1/4885
US-20190002433-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR EGFR 179/4885KDR 3/4885FLT1 1/4885

“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.