SCHEMBL2055589

SCHEMBL2055589

COc1cc2c(Nc3ccc(C)cc3F)ncnc2cc1O

nearest known ligand 0.76

Predicted protein targets (top 10)

geneUniProtsupporting neighboursconfidence
RAF1 P04049 3/20 0.76
BRAF P15056 3/20 0.76
KDR P35968 14/20 0.66
FLT1 P17948 7/20 0.66
FGFR1 P11362 5/20 0.66
RET P07949 8/20 0.65
KIF5B P33176 8/20 0.65
EGFR P00533 5/20 0.65
FLT4 P35916 3/20 0.64
EPHB2 P29323 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
SCHEMBL7866068 0.91 KDR (0.80) RAF1BRAFKDRFLT1FGFR1
Hydrochloric Acid SCHEMBL7870586 0.90 KDR (0.78) RAF1BRAFKDRFLT1FGFR1
SCHEMBL156289 0.89 KDR (0.83) RAF1BRAFKDRFLT1FGFR1
Hydrochloric Acid SCHEMBL28007000 0.88 KDR (0.81) RAF1BRAFKDRFLT1FGFR1
SCHEMBL13617351 0.88 KDR (0.65) RAF1BRAFKDRFLT1FGFR1
SCHEMBL1467058 0.88 KDR (0.83) RAF1BRAFKDRFLT1FGFR1
SCHEMBL15051762 0.86 RAF1 (1.00) RAF1BRAF
SCHEMBL8684 0.85 KDR (0.82) RAF1BRAFKDRFLT1FGFR1
SCHEMBL7215803 0.85 KDR (0.89) RAF1BRAFKDRFLT1FGFR1
SCHEMBL21557441 0.84 KDR (0.71) RAF1BRAFKDRFLT1FGFR1

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 24 patents — showing the first 20. 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-20180118716-A1 Chemical Process GENZYME CORPORATION (US) 2018-05-03 US disclosed
US-20180099946-A1 Quinazoline Derivatives as VEGF Inhibitors GENZYME CORPORATION (US) 2018-04-12 US disclosed
US-9815816-B2 Chemical process for the synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline GENZYME CORPORATION (US) 2017-11-14 US disclosed
US-20160185754-A1 Chemical Process for the Synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline ASTRAZENECA AB (SE) 2016-06-30 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-20120095229-A1 CHEMICAL PROCESS GENZYME CORPORATION 2012-04-19 US disclosed
US-20110065736-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS ASTRAZENECA AB (SE) 2011-03-17 US disclosed
WO-2010028254-A2 SUBSTITUTED QUINAZOLINE INHIBITORS OF GROWTH FACTOR RECEPTOR TYROSINE KINASES AUSPEK PHARMACEUTICALS, INC. (US) 2010-03-11 WO disclosed
US-20090203905-A1 CHEMICAL PROCESS GENZYME CORPORATION 2009-08-13 US disclosed
EP-1676845-B1 New quinazoline derivatives ASTRAZENECA AB (SE) 2008-06-11 EP 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 (11 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 RAF1 74/4885BRAF 111/4885KDR 3/4885
US-20210276972-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR RAF1 131/4885BRAF 289/4885KDR 3/4885
US-20110065736-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS FLT1, FLT4, KDR RAF1 62/4885BRAF 88/4885KDR 3/4885
US-10457664-B2 Quinazoline derivatives as VEGF inhibitors FLT1, FLT4, KDR RAF1 66/4885BRAF 77/4885KDR 3/4885
US-20090203905-A1 CHEMICAL PROCESS CYP3A4, CYP3A5, CYP3A7 RAF1 543/4885BRAF 747/4885KDR 3543/4885
US-20160130249-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR RAF1 64/4885BRAF 96/4885KDR 3/4885
US-20160185754-A1 Chemical Process for the Synthesis of 4-(4-bromo-2-fluoroanilino)-6-methoxy-7-(1-methylpiperidin-4-ylmethoxy)quinazoline CYP3A4, CYP3A7, CYP4B1 RAF1 767/4885BRAF 1201/4885KDR 3217/4885
US-20200262811-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR RAF1 64/4885BRAF 96/4885KDR 3/4885
US-20190002433-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR RAF1 66/4885BRAF 77/4885KDR 3/4885
US-20120095229-A1 CHEMICAL PROCESS CYP3A4, CYP3A5, CYP3A7 RAF1 543/4885BRAF 747/4885KDR 3543/4885
US-20180118716-A1 Chemical Process CYP3A4, CYP3A5, CYP3A7 RAF1 543/4885BRAF 747/4885KDR 3543/4885

“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.