SCHEMBL4577926

SCHEMBL4577926

NCCOc1cc2ncnc(Nc3ccc(F)cc3F)c2cc1[N+](=O)[O-]

nearest known ligand 0.58

Predicted protein targets (top 12)

geneUniProtsupporting neighboursconfidence
KDR P35968 15/20 0.58
FLT1 P17948 5/20 0.58
FGFR1 P11362 3/20 0.58
EGFR P00533 11/20 0.53
ABCG2 Q9UNQ0 1/20 0.49
FBP1 P09467 1/20 0.48
FLT4 P35916 2/20 0.47
RET P07949 1/20 0.47
KIF5B P33176 1/20 0.47
EPHB2 P29323 1/20 0.46
RAF1 P04049 1/20 0.46
BRAF P15056 1/20 0.46

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
SCHEMBL4579295 0.91 KDR (0.64) KDRFLT1FGFR1EGFRFBP1
SCHEMBL5091094 0.90 KDR (0.62) KDRFLT1FGFR1EGFRFLT4
SCHEMBL4578020 0.88 EGFR (0.50) KDRFLT1FGFR1EGFRABCG2
SCHEMBL5097232 0.87 KDR (0.51) KDRFLT1FGFR1EGFRABCG2
SCHEMBL4578498 0.87 KDR (0.58) KDRFLT1FGFR1EGFRFBP1
SCHEMBL4578485 0.86 EGFR (0.51) KDRFLT1EGFRABCG2FBP1
SCHEMBL4577412 0.84 KDR (0.59) KDRFLT1FGFR1EGFRABCG2
SCHEMBL4579634 0.83 SRC (0.57) KDRFLT1FGFR1EGFRABCG2
SCHEMBL4577331 0.83 KDR (0.53) KDRFLT1EGFRFBP1
SCHEMBL4576844 0.83 EGFR (0.52) EGFRABCG2FBP1

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 5 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
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
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 KDR 1226/4885FLT1 959/4885FGFR1 528/4885

“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.