SCHEMBL2138034

SCHEMBL2138034

COc1cc2c(Nc3c(F)cc(Br)cc3F)ncnc2cc1O

nearest known ligand 0.61

Predicted protein targets (top 18)

geneUniProtsupporting neighboursconfidence
KDR P35968 14/20 0.61
RET P07949 10/20 0.61
KIF5B P33176 10/20 0.61
EGFR P00533 8/20 0.61
FGFR1 P11362 4/20 0.60
FLT1 P17948 4/20 0.60
FLT4 P35916 3/20 0.60
FGFR2 P21802 1/20 0.59
FGFR4 P22455 1/20 0.59
FGFR3 P22607 1/20 0.59
RAF1 P04049 1/20 0.57
BRAF P15056 1/20 0.57
JAK3 P52333 2/20 0.57
ABCB1 P08183 1/20 0.57
ABCG2 Q9UNQ0 1/20 0.57
RIPK2 O43353 1/20 0.57
NOD1 Q9Y239 1/20 0.57
MKNK1 Q9BUB5 1/20 0.54

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
SCHEMBL7962820 0.90 KDR (0.73) KDRRETKIF5BEGFRFGFR1
Hydrochloric Acid SCHEMBL7215101 0.89 KDR (0.72) KDRRETKIF5BEGFRFGFR1
SCHEMBL2138123 0.88 KDR (0.69) KDRRETKIF5BEGFRFGFR1
SCHEMBL156289 0.86 KDR (0.83) KDRRETKIF5BEGFRFGFR1
Hydrochloric Acid SCHEMBL28007000 0.85 KDR (0.81) KDRRETKIF5BEGFRFGFR1
SCHEMBL5241456 0.81 KDR (0.83) KDRRETKIF5BEGFRFGFR1
SCHEMBL2137462 0.79 EGFR (0.64) KDRRETKIF5BEGFRFGFR1
Trifluoroacetic Acid SCHEMBL29372105 0.79 KDR (0.70) KDRRETKIF5BEGFRFGFR1
Trifluoroacetic Acid SCHEMBL2089050 0.79 KDR (0.70) KDRRETKIF5BEGFRFGFR1
SCHEMBL1781767 0.79 KDR (0.71) KDRRETKIF5BEGFRFGFR1

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-10457664-B2 Quinazoline derivatives as VEGF inhibitors GENZYME CORPORATION (US) 2019-10-29 US claimed
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 KDR 3/4885RET 503/4885KIF5B 2509/4885
US-20210276972-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR KDR 3/4885RET 624/4885KIF5B 2589/4885
US-20110065736-A1 QUINAZOLINE DERIVATIVES AS VEGF INHIBITORS FLT1, FLT4, KDR KDR 3/4885RET 526/4885KIF5B 2469/4885
US-10457664-B2 Quinazoline derivatives as VEGF inhibitors FLT1, FLT4, KDR KDR 3/4885RET 509/4885KIF5B 2441/4885
US-20070265286-A1 Quinazoline derivatives as VEGF inhibitors FLT1, FLT4, KDR KDR 3/4885RET 526/4885KIF5B 2469/4885
US-20160130249-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR KDR 3/4885RET 446/4885KIF5B 2463/4885
US-20140121228-A1 Quinazoline Derivatives as VEGF Inhibitors FLT4, FLT1, KDR KDR 3/4885RET 583/4885KIF5B 2900/4885
US-20200262811-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR KDR 3/4885RET 446/4885KIF5B 2463/4885
US-20190002433-A1 Quinazoline Derivatives as VEGF Inhibitors FLT1, FLT4, KDR KDR 3/4885RET 509/4885KIF5B 2441/4885

“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.