SCHEMBL2255508

SCHEMBL2255508

CS(=O)(=O)CCNCC(=O)NCCC(=O)Nc1ccc2ncnc(Nc3ccc(OCc4cccc(F)c4)c(Cl)c3)c2c1

nearest known ligand 0.74

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
ERBB2 P04626 15/20 0.74
EGFR P00533 17/20 0.67
MEN1 O00255 3/20 0.64
KMT2A Q03164 3/20 0.64
ERBB4 Q15303 2/20 0.64
CYP3A4 P08684 2/20 0.64
ABCB11 O95342 2/20 0.64
PIK3C2B O00750 1/20 0.64
MAP2K7 O14733 1/20 0.64
RIPK2 O43353 1/20 0.64
PIK3C2G O75747 1/20 0.64
STK10 O94804 1/20 0.64
ABL1 P00519 1/20 0.64
INSR P06213 1/20 0.64
RET P07949 1/20 0.64
PDGFRB P09619 1/20 0.64
SRC P12931 1/20 0.64
CYP3A5 P20815 1/20 0.64
ERBB3 P21860 1/20 0.64
CDK2 P24941 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
SCHEMBL2254686 0.96 ERBB2 (0.72) ERBB2EGFRMEN1KMT2AERBB4
SCHEMBL2250352 0.91 EGFR (0.72) ERBB2EGFRMEN1KMT2AERBB4
SCHEMBL2251080 0.91 EGFR (0.67) ERBB2EGFRMEN1KMT2AERBB4
SCHEMBL2249596 0.91 ERBB2 (0.76) ERBB2EGFRERBB4ABL1INSR
SCHEMBL15162975 0.89 EGFR (0.62) ERBB2EGFRMEN1KMT2AERBB4
SCHEMBL2253186 0.87 EGFR (0.82) ERBB2EGFRERBB4ABL1INSR
SCHEMBL2249096 0.87 EGFR (0.70) ERBB2EGFRMEN1KMT2AERBB4
SCHEMBL2251577 0.87 EGFR (0.74) ERBB2EGFRERBB4ABL1INSR
SCHEMBL2253803 0.87 ERBB2 (0.74) ERBB2EGFRERBB4ABL1INSR
SCHEMBL2255321 0.87 EGFR (0.75) ERBB2EGFRERBB4ABL1INSR

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

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-8003658-B2 Quinazoline derivatives for inhibiting cancer cell growth and method for the preparation thereof HANMI HOLDINGS CO., LTD. (KR) 2011-08-23 US claimed
US-20080009509-A1 Quinazoline Derivatives For Inhibiting Cancer Cell Growth And Method For The Preparation Thereof HANMI PHARM CO., LTD (KR) 2008-01-10 US claimed
CN-101094840-A Quinazoline derivatives for inhibiting the growth of cancer cells and methods for preparing the same HANMI PHARM IND CO LTD (KR) 2007-12-26 CN claimed
EP-1844022-B1 QUINAZOLINE DERIVATIVES FOR INHIBITING CANCER CELL GROWTH AND METHOD FOR THE PREPARATION THEREOF HANMI SCIENCE CO LTD (KR) 2013-08-14 EP disclosed
CN-101094840-B Quinazoline derivatives for inhibiting the growth of cancer cells and methods for preparing the same HANMI PHARM IND CO LTD 2012-10-31 CN disclosed
US-8003658-B2 Quinazoline derivatives for inhibiting cancer cell growth and method for the preparation thereof HANMI HOLDINGS CO., LTD. (KR) 2011-08-23 US disclosed
US-20080009509-A1 Quinazoline Derivatives For Inhibiting Cancer Cell Growth And Method For The Preparation Thereof HANMI PHARM CO., LTD (KR) 2008-01-10 US disclosed
CN-101094840-A Quinazoline derivatives for inhibiting the growth of cancer cells and methods for preparing the same HANMI PHARM IND CO LTD (KR) 2007-12-26 CN disclosed
EP-1844022-A1 QUINAZOLINE DERIVATIVES FOR INHIBITING CANCER CELL GROWTH AND METHOD FOR THE PREPARATION THEREOF Hanmi Pharm. Co., Ltd. (KR) 2007-10-17 EP disclosed
WO-2006071017-A1 QUINAZOLINE DERIVATIVES FOR INHIBITING CANCER CELL GROWTH AND METHOD FOR THE PREPARATION THEREOF HANMI PHARM. CO., LTD. (KR) 2006-07-06 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-20080009509-A1 Quinazoline Derivatives For Inhibiting Cancer Cell Growth And Method For The Preparation Thereof MKI67, NQO2, H4C1; H4C2; H4C3; H4C4; H4C5; H4C6; H4C8; H4C9; H4C11; H4C12; H4C13; H4C14; H4C15; H4C16 ERBB2 1693/4885EGFR 1400/4885MEN1 822/4885

“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.