SCHEMBL4579165

SCHEMBL4579165

COc1cc(Nc2ncnc3cc(OCCNC(=O)O)c([N+](=O)[O-])cc23)c(Cl)cc1Cl

nearest known ligand 0.60

Predicted protein targets (top 8)

geneUniProtsupporting neighboursconfidence
KDR P35968 13/20 0.60
EGFR P00533 10/20 0.60
RIPK2 O43353 1/20 0.57
SRC P12931 1/20 0.57
NOD1 Q9Y239 1/20 0.57
RET P07949 2/20 0.50
ABCG2 Q9UNQ0 2/20 0.50
KIF5B P33176 1/20 0.50

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
SCHEMBL4579090 0.96 EGFR (0.59) KDREGFRRIPK2SRCNOD1
SCHEMBL4577032 0.93 KDR (0.69) KDREGFRRIPK2SRCNOD1
SCHEMBL4577670 0.93 KDR (0.61) KDREGFRABCG2
SCHEMBL4578473 0.92 KDR (0.56) KDREGFRRIPK2SRCNOD1
SCHEMBL4578140 0.89 EGFR (0.69) KDREGFRRIPK2SRCNOD1
SCHEMBL4578322 0.87 EGFR (0.62) KDREGFRRIPK2SRCNOD1
SCHEMBL4580086 0.86 KDR (0.58) KDREGFRSRCABCG2
SCHEMBL4578088 0.86 KDR (0.67) KDREGFR
SCHEMBL4579832 0.86 KDR (0.70) KDREGFR
SCHEMBL4577772 0.85 EGFR (0.59) KDREGFR

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 1226/4885EGFR 955/4885RIPK2 483/4885

“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.