SCHEMBL4579035

SCHEMBL4579035

O=[N+]([O-])c1cc2c(Nc3c(F)cc(Br)cc3F)ncnc2cc1F

nearest known ligand 0.51

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
EGFR P00533 16/20 0.51
FBP1 P09467 1/20 0.47
KDR P35968 5/20 0.44
FGFR1 P11362 3/20 0.44
FLT1 P17948 3/20 0.44
FLT4 P35916 3/20 0.44
FGFR2 P21802 1/20 0.43
FGFR4 P22455 1/20 0.43
FGFR3 P22607 1/20 0.43
ABCG2 Q9UNQ0 1/20 0.42
RET P07949 1/20 0.42
KIF5B P33176 1/20 0.42
MEN1 O00255 1/20 0.42
ALDH1A1 P00352 1/20 0.42
TNF P01375 1/20 0.42
POLB P06746 1/20 0.42
MAPT P10636 1/20 0.42
CRHBP P24387 1/20 0.42
MAPK1 P28482 1/20 0.42
HTT P42858 1/20 0.42

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
SCHEMBL159918 0.86 EGFR (0.52) EGFRFBP1ABCG2
SCHEMBL4577295 0.86 EGFR (0.60) EGFRFBP1KDRABCG2RET
SCHEMBL4579662 0.84 FBP1 (0.54) EGFRFBP1KDRFGFR1FLT1
SCHEMBL1418279 0.81 EGFR (0.77) EGFRFBP1
SCHEMBL4578621 0.81 EGFR (0.47) EGFRFBP1KDRFGFR1FLT1
SCHEMBL4578463 0.81 EGFR (0.62) EGFRFBP1KDRABCG2RET
SCHEMBL4579486 0.80 EGFR (0.56) EGFRFBP1ABCG2
SCHEMBL4578205 0.79 EGFR (0.57) EGFRFBP1KDRFGFR1FLT1
SCHEMBL15929508 0.79 EGFR (0.49) EGFRFBP1ABCG2POLB
SCHEMBL4579881 0.79 EGFR (0.50) EGFRFBP1KDRABCG2RET

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8846699-B2 Quinazoline derivatives as a multiplex inhibitor and method for the preparation thereof HANMI PHARM. CO., LTD. (KR) 2014-09-30 US disclosed
EP-1951686-B1 QUINAZOLINE DERIVATIVES AS A MULTIPLEX INHIBITOR AND METHOD FOR THE PREPARATION THEREOF HANMI PHARM IND CO LTD (KR) 2013-04-03 EP disclosed
CN-101304978-B Quinazoline derivative as multi-component inhibitor, pharmaceutical composition and application HANMI PHARM IND CO LTD 2012-12-26 CN disclosed
US-20080318950-A1 Quinazoline Derivatives as a Multiplex Inhibitor and Method For the Preparation Thereof HANMI PHARM. CO., LTD (KR) 2008-12-25 US disclosed
CN-101304978-A Quinazoline derivatives as multiplex inhibitors and process for their preparation HANMI PHARM IND CO LTD (KR) 2008-11-12 CN disclosed
EP-1951686-A1 QUINAZOLINE DERIVATIVES AS A MULTIPLEX INHIBITOR AND METHOD FOR THE PREPARATION THEREOF Hanmi Pharm. Co., Ltd. (KR) 2008-08-06 EP disclosed
WO-2007055514-A1 QUINAZOLINE DERIVATIVES AS A MULTIPLEX INHIBITOR AND METHOD FOR THE PREPARATION THEREOF HANMI PHARM. CO., LTD. (KR) 2007-05-18 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 (1 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-20080318950-A1 Quinazoline Derivatives as a Multiplex Inhibitor and Method For the Preparation Thereof ABL1, JAK1, BTK EGFR 955/4885FBP1 3705/4885KDR 1226/4885

“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.